Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | FABP2 | P12104 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL3917066 | 1.00 | NPC1 (0.47) | NPC1RAB9AMAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL13840715 | 0.92 | ADRB2 (0.49) | NPC1RAB9AMAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL3924003 | 0.92 | ADRB2 (0.49) | NPC1RAB9AMAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL13840706 | 0.87 | PARP1 (0.46) | MAPTPARP1ADRB2ADRB1 | |
| SCHEMBL3914423 | 0.87 | PARP1 (0.46) | MAPTPARP1ADRB2ADRB1 | |
| SCHEMBL3924678 | 0.87 | PARP1 (0.44) | NPC1RAB9AGAAPARP1ADRB2 | |
| SCHEMBL13840701 | 0.87 | PARP1 (0.44) | NPC1RAB9AGAAPARP1ADRB2 | |
| SCHEMBL13840733 | 0.87 | ADRB2 (0.55) | SMN1; SMN2ADRB2ALDH1A1 | |
| SCHEMBL3915467 | 0.87 | ADRB2 (0.55) | SMN1; SMN2ADRB2ALDH1A1 | |
| SCHEMBL4388116 | 0.86 | ADRB2 (0.61) | CYP1A2CYP2D6ADRB2ADRB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1730141-B1 | COMPOUNDS FOR THE TREATMENT OF DISEASES | PFIZER LTD (GB) | 2009-05-27 | — | — | EP | disclosed |
| US-7538141-B2 | Compounds for the treatment of diseases | PFIZER INC. | 2009-05-26 | — | — | US | disclosed |
| US-7538141-B2 | Compounds for the treatment of diseases | PFIZER INC. | 2009-05-26 | — | — | US | disclosed |