Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 6/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.38 |
| ▸ | DRD2 | P14416 | 4/20 | 0.38 |
| ▸ | DRD4 | P21917 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29199033 | 0.80 | CYP2D6 (0.35) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL9009806 | 0.79 | HTR2A (0.40) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL4140643 | 0.77 | CYP2D6 (0.38) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL10920895 | 0.76 | HTR2A (0.38) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL1383327 | 0.73 | CYP2D6 (0.35) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL359803 | 0.70 | CHRNB2 (0.44) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL14395237 | 0.70 | CHRNB2 (0.44) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| SCHEMBL1566232 | 0.70 | PNMT (0.42) | DRD1MAPK1CYP2D6KDM4EMAPT | |
| SCHEMBL29568322 | 0.70 | CHRNB2 (0.44) | DRD1MAPK1DRD2DRD4CYP2D6 | |
| Hydrochloric Acid SCHEMBL5078583 | 0.68 | MAPT (0.42) | MAPK1CYP2D6KDM4EMAPTALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4316032-A | Oximino-imino-isoindoline metal complexes useful as pigments | SANDOZ LTD. (CH) | 1982-02-16 | — | — | US | disclosed |