Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | TYMP | P19971 | 1/20 | 0.40 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL5252725 | 0.89 | TAAR1 (0.60) | TAAR1GAANPC1RAB9AAMY1A | |
| SCHEMBL11323610 | 0.87 | TAAR1 (0.43) | TAAR1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL1276089 | 0.85 | CYP3A4 (0.57) | TAAR1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL30702302 | 0.84 | TAAR1 (0.44) | TAAR1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL3440599 | 0.84 | TAAR1 (0.44) | TAAR1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL1409748 | 0.84 | AMY1A (0.65) | TSHRCYP3A4CYP2D6CYP2C19AMY1A | |
| SCHEMBL9718454 | 0.84 | LMNA (0.44) | TAAR1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL29477327 | 0.83 | TAAR1 (0.56) | TAAR1TSHRCNR2TYMPGPR55 | |
| SCHEMBL2090458 | 0.83 | TAAR1 (0.56) | TAAR1TSHRCNR2TYMPGPR55 | |
| SCHEMBL5551682 | 0.82 | TAAR1 (0.54) | TAAR1TSHRCYP3A4CYP2D6CYP2C19 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |
| US-4957815-A | RUPTURABLE MICROCAPSULES | SOCIETE ATOCHEM | 1990-09-18 | — | — | US | disclosed |
| US-4117019-A | MANUFACTURE OF O-BENZYLTOLUENES | BASF AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-3978144-A | MANUFACTURE OF O-BENZYLTOLUENES | BASF AKTIENGESELLSCHAFT (DT) | 1976-08-31 | — | — | US | disclosed |
| US-3939095-A | PHENYLINDANES, ADDITION COPOLYMERS | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1976-02-17 | — | — | US | disclosed |