Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.53 |
| ▸ | IDO1 | P14902 | 5/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7765314 | 1.00 | TAAR1 (0.53) | TAAR1IDO1GRIN2BTSHRTP53 | |
| SCHEMBL7760203 | 0.80 | TAAR1 (0.49) | TAAR1IDO1GRIN2BSMN1; SMN2HRH3 | |
| SCHEMBL7104418 | 0.80 | TAAR1 (0.49) | TAAR1IDO1GRIN2BSMN1; SMN2HRH3 | |
| SCHEMBL7104421 | 0.80 | TAAR1 (0.49) | TAAR1IDO1GRIN2BSMN1; SMN2HRH3 | |
| SCHEMBL7767280 | 0.79 | ALDH1A1 (0.44) | LMNAKDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL7767283 | 0.79 | ALDH1A1 (0.44) | LMNAKDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL9219198 | 0.77 | MIF (0.41) | TAAR1IDO1GRIN2BTSHRLMNA | |
| SCHEMBL9219195 | 0.77 | MIF (0.41) | TAAR1IDO1GRIN2BTSHRLMNA | |
| SCHEMBL4019646 | 0.74 | TAAR1 (0.74) | TAAR1IDO1GRIN2BTSHRTP53 | |
| SCHEMBL7763107 | 0.74 | GRIN2B (0.47) | IDO1GRIN2BCYP3A4ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0531702-B1 | Process for the manufacture of insecticidal, nematicidal and acaricidal 2-aryl-3-subst. -5-(trifluoromethyl)pyrrole compounds from N-(subst. benzyl)-2,2,2-trifluoroacetimidoyl chloride compounds | BASF AG (DE) | 2001-05-30 | — | — | EP | disclosed |
| EP-0531702-A1 | Process for the manufacture of insecticidal, nematicidal and acaricidal 2-aryl-3-substitued-5-(trifluoromethyl)pyrrole compounds from N-(substituted benzyl)-2,2,2-trifluoroacetimidoyl chloride compounds | AMERICAN CYANAMID COMPANY (US) | 1993-03-17 | — | — | EP | disclosed |
| US-5145986-A | Process for the manufacture of insecticidal, nematicidal and acaricidal 2-aryl-3-substituted-5-(trifluoromethyl)pyrrole compounds from N-(substituted benzyl)-2,2,2-trifluoro-acetimidoyl chloride compounds | AMERICAN CYANAMID COMPANY (US) | 1992-09-08 | — | — | US | disclosed |