Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 12/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | MLYCD | O95822 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.44 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2857918 | 0.88 | CCR1 (0.54) | HPGDCYP1A2CYP2D6CYP2C19CYP3A4 | |
| SCHEMBL2859060 | 0.80 | ALDH1A1 (0.46) | TACR1KDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL2859054 | 0.78 | POLB (0.71) | KDM4EALDH1A1HPGDGAANPC1 | |
| SCHEMBL2723763 | 0.76 | L3MBTL1 (0.54) | TACR1ALDH1A1NPC1LMNAPOLB | |
| SCHEMBL2860256 | 0.75 | CNR1 (0.58) | KDM4EALDH1A1HPGDNPC1LMNA | |
| SCHEMBL17546622 | 0.72 | KLKB1 (0.58) | KDM4ENPC1LMNAPOLB | |
| SCHEMBL13753976 | 0.72 | KDM4E (0.69) | KDM4EALDH1A1GAANPC1LMNA | |
| SCHEMBL4305835 | 0.71 | TACR1 (0.60) | TACR1MLYCDP2RX1TMPRSS4 | |
| SCHEMBL6301053 | 0.70 | MTOR (0.58) | TACR1ALDH1A1CYP3A4MLYCDP2RX1 | |
| SCHEMBL15525064 | 0.70 | POLB (0.52) | KDM4EALDH1A1GAANPC1LMNA |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | disclosed |