Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAT2A | P31153 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 2/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4772467 | 0.89 | MAT2A (0.40) | SMN1; SMN2HPGDNPC1RAB9ATSHR | |
| SCHEMBL4776782 | 0.86 | CDK1 (0.33) | SMN1; SMN2HPGDNPC1RAB9ATSHR | |
| SCHEMBL4529801 | 0.84 | SMN1; SMN2 (0.39) | SMN1; SMN2HPGDNPC1RAB9ATSHR | |
| SCHEMBL4778102 | 0.83 | MAPK1 (0.36) | SMN1; SMN2NPC1RAB9ATSHRKDM4E | |
| SCHEMBL4522510 | 0.80 | GSR (0.40) | SMN1; SMN2HPGDNPC1RAB9ATSHR | |
| SCHEMBL4774078 | 0.79 | MEN1 (0.38) | SMN1; SMN2CDK1KDM4EALDH1A1MEN1 | |
| SCHEMBL4256906 | 0.78 | BRD4 (0.40) | CYP2C19 | |
| SCHEMBL4531589 | 0.78 | HKDC1 (0.39) | SMN1; SMN2HPGDNPC1RAB9ATSHR | |
| SCHEMBL4357095 | 0.77 | MAT2A (0.38) | SMN1; SMN2HPGDNPC1RAB9ATSHR | |
| SCHEMBL4518958 | 0.76 | SMN1; SMN2 (0.43) | SMN1; SMN2HPGDNPC1RAB9ATSHR |
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-1881988-A1 | 2,3-SUBSTITUTED FUSED BICYCLIC PYRIMIDIN-4(3H)-ONES MODULATING THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LTD. (GB) | 2008-01-30 | — | — | EP | disclosed |
| WO-2006122200-A1 | 2,3-SUBSTITUTED FUSED BICYCLIC PYRIMIDIN-4(3H)-ONES MODULATING THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LIMITED (GB) | 2006-11-16 | — | — | WO | disclosed |