Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.39 |
| ▸ | PNMT | P11086 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8094251 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TAAR1PNMTLMNAHPGD | |
| SCHEMBL10519032 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TAAR1PNMTLMNAHPGD | |
| SCHEMBL5527194 | 0.79 | TAAR1 (0.64) | ALDH1A1TAAR1PNMT | |
| SCHEMBL1290396 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TAAR1PNMTLMNAHPGD | |
| SCHEMBL3001711 | 0.78 | TAAR1 (0.63) | ALDH1A1TAAR1PNMTIDO1P2RX7 | |
| SCHEMBL1674574 | 0.78 | TAAR1 (0.60) | TAAR1PNMTLMNASLC6A2SLC6A4 | |
| SCHEMBL8094335 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TAAR1PNMTLMNAHPGD | |
| SCHEMBL79911 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TAAR1PNMTLMNAHPGD | |
| SCHEMBL79270 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TAAR1PNMTLMNAHPGD | |
| SCHEMBL3119523 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TAAR1PNMTLMNAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5064962-A | DIAMINOTHIOPHENES | BASF AKTIENGESELLSCHAFT (DE) | 1991-11-12 | — | — | US | disclosed |
| EP-0384314-A2 | Diaminothiophenes | BASF Aktiengesellschaft (DE) | 1990-08-29 | — | — | EP | disclosed |