Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE2 | P0DPD6 | 1/20 | 0.42 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
| ▸ | TUBB | P07437 | 1/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31287240 | 1.00 | ECE2 (0.42) | ECE2SHMT2TDP1NPC1RAB9A | |
| SCHEMBL4280865 | 0.88 | ECE2 (0.41) | ECE2SHMT2TDP1NPC1RAB9A | |
| Bromide SCHEMBL4280985 | 0.86 | ECE2 (0.40) | ECE2SHMT2TDP1NPC1RAB9A | |
| SCHEMBL843959 | 0.83 | ECE2 (0.45) | ECE2SHMT2TDP1NPC1RAB9A | |
| SCHEMBL6851853 | 0.79 | ECE2 (0.42) | ECE2SHMT2TDP1NPC1RAB9A | |
| SCHEMBL9971308 | 0.79 | CNR1 (0.44) | ECE2SHMT2NPC1RAB9AMAPT | |
| SCHEMBL5155836 | 0.79 | KDM4E (0.47) | ECE2SHMT2TDP1NPC1RAB9A | |
| SCHEMBL2859216 | 0.79 | TAAR1 (0.45) | ECE2SHMT2TDP1L3MBTL1MAPT | |
| SCHEMBL5151371 | 0.79 | ECE2 (0.42) | ECE2SHMT2TDP1NPC1RAB9A | |
| SCHEMBL31287242 | 0.79 | KDM4E (0.47) | ECE2SHMT2TDP1NPC1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1968948-A | Process for preparing gonadotropin releasing hormone receptor antagonists | WYETH CORP (US) | 2007-05-23 | — | — | CN | claimed |
| CN-102775396-B | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-10-08 | — | — | CN | disclosed |
| CN-102775396-A | Modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2012-11-14 | — | — | CN | disclosed |
| CN-101356170-B | Heterocyclic modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2012-09-26 | — | — | CN | disclosed |
| CN-101356170-A | Heterocyclic modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2009-01-28 | — | — | CN | disclosed |
| CN-101006078-A | Gonadotropin releasing hormone receptor antagonists | WYETH CORP (US) | 2007-07-25 | — | — | CN | disclosed |
| CN-1968948-A | Process for preparing gonadotropin releasing hormone receptor antagonists | WYETH CORP (US) | 2007-05-23 | — | — | CN | disclosed |
| EP-1758895-A1 | GONADOTROPIN RELEASING HORMONE RECEPTOR ANTAGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2007-03-07 | — | — | EP | disclosed |
| CN-1256326-C | Novel 4- (oxoxyphenyl) -3-oxopiperidines for the treatment of cardiac and renal insufficiency | HOFFMANN LA ROCHE (CH) | 2006-05-17 | — | — | CN | disclosed |
| WO-2006009734-A1 | GONADOTROPIN RELEASING HORMONE RECEPTOR ANTAGONISTS | WYETH (US) | 2006-01-26 | — | — | WO | disclosed |
| CN-1202152-A | Novel 4- (oxoxyphenyl) -3-oxopiperidines for the treatment of cardiac and renal insufficiency | HOFFMANN LA ROCHE (CH) | 1998-12-16 | — | — | CN | disclosed |
| CN-1031266-C | Process for preparation of heterocycle ether derivatives | ZENECA LTD (GB) | 1996-03-13 | — | — | CN | disclosed |
| CN-1046903-A | Process for preparing heterocyclic ether derivatives | ICI PLC (GB) | 1990-11-14 | — | — | CN | disclosed |