Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR5 | P32302 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | TDP2 | O95551 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4520334 | 0.99 | CXCR5 (0.43) | CXCR5GAAPOLBDPP7ALDH1A1 | |
| SCHEMBL4795018 | 0.97 | CXCR5 (0.42) | CXCR5GAAPOLBDPP7ALDH1A1 | |
| SCHEMBL13360618 | 0.86 | DPP7 (0.41) | CXCR5GAAPOLBDPP7ALDH1A1 | |
| SCHEMBL16595774 | 0.81 | OPRM1 (0.46) | CXCR5POLBNPSR1CYP1A2CYP2C9 | |
| SCHEMBL13259212 | 0.81 | OPRM1 (0.43) | GAAALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13259214 | 0.79 | ESR1 (0.39) | ESR1ESR2SMN1; SMN2 | |
| SCHEMBL22898433 | 0.78 | LMNA (0.42) | GAAALDH1A1CYP1A2ESR1ESR2 | |
| SCHEMBL31537527 | 0.78 | ESR1 (0.40) | DPP7ALDH1A1NPSR1ESR1ESR2 | |
| SCHEMBL795467 | 0.78 | ESR1 (0.40) | DPP7ALDH1A1NPSR1ESR1ESR2 | |
| SCHEMBL30267475 | 0.77 | OPRM1 (0.40) | CXCR5POLBALDH1A1ESR1ESR2 |
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 |