Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 2/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | MLNR | O43193 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10693468 | 0.76 | CTNNB1 (0.47) | ATMSLC6A2SLC6A4MTNR1AMTNR1B | |
| SCHEMBL8372906 | 0.72 | TDP1 (0.72) | CYP4F2CYP4A11TDP1ESR1ESR2 | |
| SCHEMBL30513304 | 0.70 | ESR1 (0.61) | TDP1ESR1ESR2DRD2DRD3 | |
| SCHEMBL30616222 | 0.70 | NPC1 (0.38) | CYP4F2CYP4A11TDP1ESR1ESR2 | |
| SCHEMBL3269864 | 0.70 | ESR1 (0.61) | TDP1ESR1ESR2DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL6787778 | 0.70 | CYP4F2 (0.46) | CYP4F2CYP4A11TDP1ALDH1A1HSD17B10 | |
| SCHEMBL18743290 | 0.69 | CREBBP (0.44) | CYP4F2CYP4A11TDP1ESR1ESR2 | |
| SCHEMBL11926950 | 0.69 | CREBBP (0.44) | CYP4F2CYP4A11TDP1ESR1ESR2 | |
| SCHEMBL15803237 | 0.68 | TDP1 (0.36) | TDP1ESR1ESR2DRD2DRD3 | |
| SCHEMBL23940440 | 0.67 | TDP1 (0.38) | CYP4F2CYP4A11TDP1ESR1ESR2 |
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-4791104-A | HYPOTENSIVE, ANTILIPEMIC, ANTIHROMBOTIC, ANTIHYPOXIC AGENTS | MAGGIONI-WINTHROP S.P.A. (IT) | 1988-12-13 | — | — | US | disclosed |
| WO-1987002359-A1 | DIHYDROBENZOTHIOPHENE AND THIOCHROMANE AMINOALCOHOLS | MAGGIONI-WINTHROP S.P.A. (IT) | 1987-04-23 | — | — | WO | disclosed |