Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 7/20 | 0.52 |
| ▸ | PTAFR | P25105 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.42 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7548979 | 0.83 | TRPV1 (0.41) | TRPV1MAPTALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL6844711 | 0.83 | NR1H4 (0.53) | TRPV1MAPTALDH1A1POLBDDR1 | |
| SCHEMBL7495398 | 0.82 | MAPK1 (0.53) | TRPV1ALDH1A1MAPK1TSHR | |
| SCHEMBL7541960 | 0.73 | MEN1 (0.39) | MAPTALDH1A1CYP1A2CYP3A4HTR1A | |
| SCHEMBL6846506 | 0.72 | THRB (0.49) | MAPK1TSHR | |
| Hydrochloric Acid SCHEMBL6846557 | 0.70 | RAB9A (0.56) | MAPTALDH1A1POLB | |
| SCHEMBL10588864 | 0.68 | MEN1 (0.67) | MAPTPOLB | |
| SCHEMBL6846730 | 0.67 | MAPT (0.39) | MAPTCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL24933360 | 0.66 | RAB9A (0.73) | TRPV1MAPTALDH1A1CYP1A2TDP1 | |
| SCHEMBL12977867 | 0.66 | ALDH1A1 (0.60) | TRPV1MAPTALDH1A1MAPK1TSHR |
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-1252146-A1 | AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES | AGOURON PHARMACEUTICALS, INC. (US) | 2002-10-30 | — | — | EP | disclosed |
| WO-2001053274-A1 | AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES | AGOURON PHARMACEUTICALS, INC. (US) | 2001-07-26 | — | — | WO | disclosed |