Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.62 |
| ▸ | SMO | Q99835 | 1/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 2/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4971491 | 1.00 | HDAC1 (0.62) | HDAC1SMOKCNH2MCHR1RAB9A | |
| SCHEMBL4971127 | 0.92 | SMO (0.59) | HDAC1SMORAB9AMAPK7IKBKB | |
| SCHEMBL4972146 | 0.92 | SMO (0.59) | HDAC1SMORAB9AMAPK7IKBKB | |
| SCHEMBL403080 | 0.92 | SMO (0.70) | HDAC1SMOKCNH2MCHR1RAB9A | |
| SCHEMBL404107 | 0.92 | SMO (0.70) | HDAC1SMOKCNH2MCHR1RAB9A | |
| SCHEMBL403079 | 0.92 | SMO (0.70) | HDAC1SMOKCNH2MCHR1RAB9A | |
| SCHEMBL4972109 | 0.90 | SMO (0.75) | HDAC1SMOKCNH2MCHR1RAB9A | |
| SCHEMBL4975497 | 0.87 | KCNH2 (0.57) | HDAC1SMOKCNH2RAB9ASMN1; SMN2 | |
| SCHEMBL402178 | 0.86 | SMO (0.64) | HDAC1SMORAB9ASMN1; SMN2NPC1 | |
| SCHEMBL399419 | 0.86 | SMO (0.64) | HDAC1SMORAB9ASMN1; SMN2NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1957461-A1 | BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING | Genentech, Inc. (US) | 2008-08-20 | — | — | EP | claimed |
| WO-2007059157-A1 | BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING | GENENTECH, INC. (US) | 2007-05-24 | — | — | WO | claimed |
| EP-1957461-A1 | BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING | Genentech, Inc. (US) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007059157-A1 | BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING | GENENTECH, INC. (US) | 2007-05-24 | — | — | WO | disclosed |