Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 5/20 | 0.56 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | TACR3 | P29371 | 4/20 | 0.52 |
| ▸ | NQO1 | P15559 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | ACP1 | P24666 | 1/20 | 0.46 |
| ▸ | ACACA | Q13085 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8616497 | 0.93 | TACR3 (0.61) | NQO2PLA2G2AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8620711 | 0.89 | ACP1 (0.60) | KDM4EALDH1A1ACP1ACACA | |
| SCHEMBL8615887 | 0.89 | RAB9A (0.47) | NQO2PLA2G2AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8616673 | 0.88 | CA2 (0.50) | NQO2PLA2G2AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8614857 | 0.87 | ABCB1 (0.55) | KDM4ESMN1; SMN2MEN1KMT2ATACR3 | |
| SCHEMBL8620866 | 0.87 | ALDH1A1 (0.46) | NQO2PLA2G2AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8613853 | 0.85 | ALDH1A1 (0.52) | KDM4EMEN1KMT2ACYP3A4ABCB1 | |
| SCHEMBL8615676 | 0.85 | ACP1 (0.48) | TACR3CYP3A4ABCB1ABCG2ACP1 | |
| SCHEMBL8616302 | 0.84 | PDE10A (0.43) | NQO2PLA2G2AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8615684 | 0.84 | ESR1 (0.43) | MEN1KMT2ATACR3CYP3A4ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0726254-B1 | Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds | MITSUI TOATSU CHEMICALS (JP) | 1998-05-06 | — | — | EP | disclosed |
| US-5627193-A | MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-05-06 | — | — | US | disclosed |
| EP-0726254-A1 | Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-08-14 | — | — | EP | disclosed |