Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAT2A | P31153 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL4768907 | 0.89 | SMN1; SMN2 (0.34) | MAT2AKMT2AALDH1A1TSHRRXFP1 | |
| SCHEMBL4507591 | 0.86 | MAT2A (0.43) | MAT2AKMT2AALDH1A1TSHRPOLB | |
| SCHEMBL4778102 | 0.85 | MAPK1 (0.36) | KMT2AALDH1A1TSHRSMN1; SMN2MEN1 | |
| SCHEMBL4776782 | 0.83 | CDK1 (0.33) | MAT2ATSHRRXFP1BRD9SMN1; SMN2 | |
| SCHEMBL4777997 | 0.82 | TSHR (0.39) | KMT2AALDH1A1TSHRPOLBKCNH2 | |
| SCHEMBL4521476 | 0.80 | GSR (0.39) | MAT2ATSHRPOLBBRD9SMN1; SMN2 | |
| SCHEMBL4357095 | 0.79 | MAT2A (0.38) | MAT2AKMT2AALDH1A1TSHRPOLB | |
| SCHEMBL4521828 | 0.79 | MAT2A (0.40) | MAT2AKMT2AALDH1A1TSHRPOLB | |
| SCHEMBL4530159 | 0.78 | MAT2A (0.43) | MAT2AKMT2AALDH1A1TSHRRXFP1 | |
| SCHEMBL4776024 | 0.78 | POLB (0.38) | KMT2AALDH1A1TSHRPOLBKCNH2 |
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 |