Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 2/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3955858 | 0.98 | ALDH1A1 (0.53) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL27596046 | 0.85 | KDM4E (0.55) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL367880 | 0.84 | KDM4E (0.59) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL28062236 | 0.84 | ALDH1A1 (0.59) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| Hydrochloric Acid SCHEMBL27596045 | 0.83 | TDP1 (0.58) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL182142 | 0.82 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL8768830 | 0.82 | KDM4E (0.57) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL29632107 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL343331 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4EMAPTCYP3A4GAA | |
| SCHEMBL29632227 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4EMAPTCYP3A4GAA |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101563347-A | Vasopressin V1a antagonists | VANTIA LTD (GB) | 2009-10-21 | — | — | CN | disclosed |
| CN-101379044-A | Heterobicyclic sulfonamide derivatives for the treatment of diabetes | HOFFMANN LA ROCHE (CH) | 2009-03-04 | — | — | CN | disclosed |
| CN-100349896-C | Benzamide derivatives as oxytocin agonists and vasopressin antagonists | FERRING BV (NL) | 2007-11-21 | — | — | CN | disclosed |
| US-7189739-B2 | Compounds and methods to treat cardiac failure and other disorders | SCIOS, INC. (US) | 2007-03-13 | — | — | US | disclosed |
| CN-1751050-A | Benzamide derivatives as oxytocin agonists and vasopressin antagonists | FERRING BV (NL) | 2006-03-22 | — | — | CN | disclosed |
| EP-1080078-B1 | HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS | SCIOS INC (US) | 2006-02-01 | — | — | EP | disclosed |
| CN-1668613-A | Flavone derivatives as cyclin dependent kinase inhibitors | NICHOLAS PIRAMAL INDIA LTD (IN) | 2005-09-14 | — | — | CN | disclosed |
| US-6589954-B1 | Indoles, benzimidazoles and benztriazoles which are substituted at the 5 or 6 position with a substituent comprising an aromatic moiety linked through a piperazine ring to said indole, benzimidazole or benztriazole are useful | SCIOS, INC. | 2003-07-08 | — | — | US | disclosed |
| US-6340685-B1 | ANTIINFLAMMATORY AGENTS | SCIOS, INC. | 2002-01-22 | — | — | US | disclosed |
| EP-1080078-A1 | HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS | SCIOS INC. (US) | 2001-03-07 | — | — | EP | disclosed |
| WO-1999061426-A1 | HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS | SCIOS INC. (US) | 1999-12-02 | — | — | WO | disclosed |