Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | POLA1 | P09884 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9325693 | 0.92 | SIGMAR1 (0.46) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL9327427 | 0.83 | SLC6A4 (0.48) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL4984411 | 0.81 | POLA1 (0.51) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL29587519 | 0.81 | POLA1 (0.51) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL5735496 | 0.77 | KDM1A (0.51) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL6567499 | 0.76 | KDM1A (0.48) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL7967461 | 0.76 | POLA1 (0.52) | KDM1APOLA1SIGMAR1 | |
| SCHEMBL5396757 | 0.76 | POLA1 (0.52) | KDM1APOLA1SIGMAR1 | |
| SCHEMBL16388051 | 0.76 | KDM1A (0.45) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL19838828 | 0.76 | CYP3A4 (0.42) | KDM1ACYP3A4CYP2C9TSHRCYP2C19 |
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-0647222-A1 | N(HETERO)-ARYL-N(HETERO)-TETRALIN-ALKYL-PIPERAZINE HAVING SEROTONINERGIC, DOPAMINERGIC AND ADRENERGIC ACTIVITY | PHARMACIA & UPJOHN S.p.A. (IT) | 1995-04-12 | — | — | EP | disclosed |
| WO-1994000441-A1 | N(HETERO)-ARYL-N(HETERO)-TETRALIN-ALKYL-PIPERAZINE HAVING SEROTONINERGIC, DOPAMINERGIC AND ADRENERGIC ACTIVITY | FARMITALIA CARLO ERBA S.R.L. (IT) | 1994-01-06 | — | — | WO | disclosed |