Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MLNR | O43193 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9475146 | 0.84 | PTGDR2 (0.42) | ALDH1A1PTGDR2TP53FFAR1MAPT | |
| SCHEMBL9476368 | 0.83 | TP53 (0.40) | ALDH1A1PTGDR2TP53KMT2AFFAR1 | |
| SCHEMBL9475728 | 0.83 | ABL1 (0.41) | ALDH1A1PTGDR2KMT2AFFAR1MAPT | |
| SCHEMBL9476156 | 0.82 | FFAR1 (0.38) | PTGDR2FFAR1MAPTGAACACNA1C | |
| SCHEMBL9476315 | 0.82 | MAPT (0.41) | ALDH1A1HTTPTGDR2KMT2AFFAR1 | |
| SCHEMBL9476961 | 0.80 | FFAR1 (0.44) | ALDH1A1HTTPTGDR2TP53KMT2A | |
| SCHEMBL9476024 | 0.80 | ALDH1A1 (0.41) | ALDH1A1PTGDR2KMT2AFFAR1GAA | |
| SCHEMBL9475639 | 0.79 | TP53 (0.40) | ALDH1A1HTTPTGDR2TP53KMT2A | |
| SCHEMBL9476282 | 0.79 | SMN1; SMN2 (0.41) | ALDH1A1HTTPTGDR2KMT2AMAPT | |
| SCHEMBL9476099 | 0.79 | POLB (0.40) | PTGDR2TP53FFAR1MAPTGAA |
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-5202330-A | Hypotensive and cardiovascular agent, reduces blood pressure in mammals | E. R. SQUIBB & SONS, INC. (US) | 1993-04-13 | — | — | US | disclosed |
| EP-0204317-A2 | 2-Thio or oxo-4-aryl or heterocyclo-1,5(2H)-pyrimidinedicarboxylic acid diesters and 3-acyl-5-pyrimidinecarboxylic acids and esters | E.R. Squibb & Sons, Inc. (US) | 1986-12-10 | — | — | EP | disclosed |