Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6544398 | 0.84 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| Hydrochloric Acid SCHEMBL7565105 | 0.83 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL6879976 | 0.81 | XIAP (0.47) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL7542146 | 0.77 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL17134660 | 0.76 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL3668093 | 0.74 | TSHR (0.43) | HDAC1HDAC8HDAC6DDB1CRBN | |
| SCHEMBL15561394 | 0.74 | PTGDR2 (0.40) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL30659272 | 0.72 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL15561354 | 0.72 | XDH (0.39) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL19439193 | 0.72 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2GAAMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1377293-A1 | ARYL AND BIARYL PIPERIDINES USED AS MCH ANTAGONISTS | PHARMACOPEIA, INC. (US) | 2004-01-07 | — | — | EP | disclosed |
| WO-2002083134-A1 | ARYL AND BIARYL PIPERIDINES USED AS MCH ANTAGONISTS | PHARMACOPEIA, INC. (US) | 2002-10-24 | — | — | WO | disclosed |