Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.51 |
| ▸ | ACP3 | P15309 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.47 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.45 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.45 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8871911 | 0.93 | TDP1 (0.54) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL10711011 | 0.87 | TDP1 (0.49) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL7297068 | 0.86 | TDP1 (0.47) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL27411478 | 0.85 | TDP1 (0.58) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL29914128 | 0.84 | TDP1 (0.56) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL20520342 | 0.84 | TDP1 (0.56) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL7824528 | 0.84 | TDP1 (0.56) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL10771744 | 0.83 | ALDH1A1 (0.50) | TDP1CYP1A2CTNNB1CYP2C9CYP2C19 | |
| SCHEMBL7287681 | 0.82 | TDP1 (0.54) | TDP1CYP1A2CTNNB1ACP3MEN1 | |
| SCHEMBL9848642 | 0.81 | ATM (0.52) | TDP1ACP3MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0231919-B1 | N-HETEROCYCLIC ALCOHOL RENIN INHIBITORS | E.R. Squibb & Sons, Inc. (US) | 1993-01-20 | — | — | EP | disclosed |
| EP-0438873-A1 | Inhibitor of ribonucleotide reductase of herpes viruses | MERCK & CO. INC. (US) | 1991-07-31 | — | — | EP | disclosed |
| US-4885292-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1989-12-05 | — | — | US | disclosed |
| EP-0231919-A2 | N-Heterocyclic alcohol renin inhibitors | E.R. Squibb & Sons, Inc. (US) | 1987-08-12 | — | — | EP | disclosed |