Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | CCNE2 | O96020 | 5/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.34 |
| ▸ | CDK2 | P24941 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | UCK2 | Q9BZX2 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4777055 | 0.90 | MEN1 (0.44) | PIM1PIM2HPGDCCNE2CCNE1 | |
| SCHEMBL4772490 | 0.89 | PIM1 (0.38) | PIM1PIM2TRPV1KMOCTSS | |
| SCHEMBL4767017 | 0.88 | POLB (0.40) | HPGDPOLBMAPTTHRBTDP1 | |
| SCHEMBL4776863 | 0.85 | PIM1 (0.34) | PIM1PIM2TRPV1CCNE2CCNE1 | |
| SCHEMBL4776840 | 0.79 | KMT2A (0.44) | HPGDPOLBMAPTMEN1KMT2A | |
| SCHEMBL4776202 | 0.79 | ALDH1A1 (0.39) | HPGDCCNE2CCNE1CDK2POLB | |
| SCHEMBL4774517 | 0.78 | MEN1 (0.42) | HPGDCCNE2CCNE1CDK2MAPT | |
| SCHEMBL4775960 | 0.76 | AVPR2 (0.36) | CTSSHPGDPOLBMEN1KMT2A | |
| SCHEMBL4776947 | 0.76 | RNASEH1 (0.49) | HPGDCCNE2CCNE1CDK2MEN1 | |
| SCHEMBL5767810 | 0.75 | KMO (0.35) | PIM1PIM2TRPV1KMOCTSS |
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 |