Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 7/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NQO1 | P15559 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7673256 | 0.87 | KDM4E (0.49) | CYP3A4KDM4EHPGDSL3MBTL1NQO1 | |
| SCHEMBL7671086 | 0.87 | MAOB (0.53) | KDM4EL3MBTL1GAAMAPTCASP1 | |
| SCHEMBL2483533 | 0.81 | KDM4E (0.52) | CYP1A2NR4A2KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL2237855 | 0.75 | MTNR1A (0.56) | CYP1A2CYP2D6CYP2C9CYP2C19PLA2G2A | |
| SCHEMBL7672321 | 0.74 | CA1 (0.46) | KDM4EMAPTALDH1A1HPGDNPSR1 | |
| SCHEMBL27806564 | 0.74 | KDM4E (0.49) | CYP1A2CYP2D6CYP2C9CYP2C19PLA2G2A | |
| SCHEMBL7669452 | 0.73 | TSHR (0.47) | KDM4EL3MBTL1GAAMAPTALOX15 | |
| SCHEMBL17197313 | 0.73 | CYP1A2 (0.56) | CYP1A2CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4316682 | 0.73 | CYP1A2 (0.56) | CYP1A2CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL26882759 | 0.72 | KDM4E (0.57) | CYP1A2CYP2D6CYP2C9CYP2C19PLA2G2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6365602-B1 | FOR THERAPY OF DEPRESSION, ANXIETY, ASTHMA, PAIN, INFLAMMATION, URINARY INCONTINENCE AND OTHER DISEASE CONDITIONS | ASTRA ZENECA AB (SE) | 2002-04-02 | — | — | US | disclosed |
| EP-1097137-A1 | N-SUBSTITUTED NAPHTHALENE CARBOXAMIDES AS NEUROKININ-RECEPTOR ANTAGONISTS | AstraZeneca AB (SE) | 2001-05-09 | — | — | EP | disclosed |
| WO-2000002859-A1 | N-SUBSTITUTED NAPHTHALENE CARBOXAMIDES AS NEUROKININ-RECEPTOR ANTAGONISTS | ASTRAZENECA AB (SE) | 2000-01-20 | — | — | WO | disclosed |