Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 4/20 | 0.40 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.40 |
| ▸ | KDM5A | P29375 | 2/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | FPR1 | P21462 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1908345 | 0.91 | RAB9A (0.44) | KDM5AKDM4CKDM5BCYP17A1HPGD | |
| SCHEMBL1905339 | 0.84 | KDM5A (0.50) | OXTRAVPR1AKDM5AKDM4CKDM5B | |
| SCHEMBL12922843 | 0.75 | CYP17A1 (0.49) | KDM5AKDM4CKDM5BCYP17A1HPGD | |
| SCHEMBL1906551 | 0.73 | LMNA (0.32) | — | |
| SCHEMBL12923215 | 0.70 | GFER (0.48) | KDM5AKDM4CKDM5BCYP17A1HPGD | |
| SCHEMBL31596129 | 0.69 | HPGD (0.44) | KDM5AKDM4CKDM5BCYP17A1HPGD | |
| SCHEMBL122538 | 0.69 | HPGD (0.47) | KDM5AKDM4CKDM5BCYP17A1HPGD | |
| SCHEMBL122430 | 0.69 | HPGD (0.44) | KDM5AKDM4CKDM5BCYP17A1HPGD | |
| SCHEMBL3517338 | 0.68 | NPC1 (0.55) | KDM5AKDM4CKDM5BHPGDRAB9A | |
| SCHEMBL1574919 | 0.68 | MAPK1 (0.63) | KDM5AKDM4CKDM5BHPGDRAB9A |
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-2320907-A1 | THERAPEUTIC COMPOUNDS | Merck & Co., Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| WO-2010017047-A1 | THERAPEUTIC COMPOUNDS | MERCK & CO., INC. (US) | 2010-02-11 | — | — | WO | disclosed |