Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1439773 | 0.83 | IDO1 (0.40) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| SCHEMBL23674772 | 0.83 | IDO1 (0.40) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| Hydrochloric Acid SCHEMBL17764464 | 0.80 | CFD (0.41) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| Hydrochloric Acid SCHEMBL17764463 | 0.80 | CFD (0.41) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| SCHEMBL29619716 | 0.79 | ALDH1A1 (0.41) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| SCHEMBL23210236 | 0.79 | ALDH1A1 (0.41) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| SCHEMBL1471049 | 0.79 | IDO1 (0.42) | ALDH1A1IDO1MAOAMAOBTDO2 | |
| SCHEMBL3175280 | 0.78 | SLC18A3 (0.41) | CYP2C19ALDH1A1CYP3A4ALOX15IDO1 | |
| SCHEMBL31018097 | 0.78 | TSHR (0.45) | ALDH1A1CYP3A4ALOX15IDO1TAAR1 | |
| SCHEMBL855188 | 0.78 | TSHR (0.45) | ALDH1A1CYP3A4ALOX15IDO1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-8198823-A | — | — | None | — | — | JP | disclosed |
| JP-H08198823-A | PRODUCTION OF 3-AMINO-3-ARYL-1-PROPANOL DERIVATIVE | NIPPON SODA CO LTD | 1996-08-06 | — | — | JP | disclosed |