Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | PRKAG1 | P54619 | 3/20 | 0.32 |
| ▸ | PRKAA1 | Q13131 | 3/20 | 0.32 |
| ▸ | PRKAB1 | Q9Y478 | 3/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | USP8 | P40818 | 1/20 | 0.31 |
| ▸ | USP7 | Q93009 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | PTPN5 | P54829 | 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 | |
|---|---|---|---|---|
| SCHEMBL9119749 | 0.84 | ESR2 (0.45) | ESR2TSHRPRKAG1PRKAA1PRKAB1 | |
| SCHEMBL2108564 | 0.75 | GALR1 (0.35) | — | |
| SCHEMBL29042953 | 0.71 | ESR2 (0.41) | ESR2NPSR1RXFP1TDP1TSHR | |
| SCHEMBL2619818 | 0.70 | GALR1 (0.34) | — | |
| SCHEMBL29412287 | 0.67 | ESR2 (0.60) | ESR2TSHRGABRG2GABRB3GABRA5 | |
| SCHEMBL222 | 0.67 | ESR2 (0.60) | ESR2TSHRGABRG2GABRB3GABRA5 | |
| SCHEMBL16060235 | 0.66 | FGF23 (0.38) | NPSR1TDP1TSHR | |
| SCHEMBL8044356 | 0.66 | ESR2 (0.46) | ESR2NPSR1RXFP1TDP1TSHR | |
| SCHEMBL4052784 | 0.66 | ESR2 (0.59) | ESR2PRKAG1PRKAA1PRKAB1GABRG2 | |
| SCHEMBL2109770 | 0.66 | WDR5 (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5463104-A | Treating human immunodeficiency virus infection | G. D. SEARLE & CO. (US) | 1995-10-31 | — | — | US | claimed |
| US-5451583-A | Angiotensin inhibitors | AMERICAN HOME PRODUCTS CORPORATION (US) | 1995-09-19 | — | — | US | disclosed |
| WO-1994011365-A1 | SUBSTITUTED BENZIMIDAZOLES AND QUINAZOLINES AS ANTIHYPERTENSIVES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1994-05-26 | — | — | WO | disclosed |
| US-5283242-A | Hypotensive agents, cardiotonic agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1994-02-01 | — | — | US | disclosed |