Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 2/20 | 0.47 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
| ▸ | RUVBL1 | Q9Y265 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.41 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28691056 | 0.86 | PLA2G2A (0.53) | DHODHPLA2G2ACA9CA12CA1 | |
| SCHEMBL28672796 | 0.85 | MCL1 (0.46) | PLA2G2A | |
| SCHEMBL1900644 | 0.79 | STAT3 (0.57) | DHODHPLA2G2AKDM4ENPSR1RUVBL1 | |
| SCHEMBL28679437 | 0.77 | DHODH (0.48) | DHODHPLA2G2ATRPV1CA9CA12 | |
| SCHEMBL1896811 | 0.74 | DHODH (0.72) | DHODHPLA2G2ATRPV1KDM4ECYP2C9 | |
| SCHEMBL28696167 | 0.73 | MCL1 (0.55) | PLA2G2ACA9CA12CA1CA2 | |
| SCHEMBL28931959 | 0.73 | STAT3 (0.59) | CYP3A4KDM4ETACR3USP2ALDH1A1 | |
| SCHEMBL28691066 | 0.73 | CYP3A4 (0.68) | CYP3A4KDM4ENPSR1TACR3RUVBL1 | |
| SCHEMBL1900802 | 0.72 | STAT3 (0.70) | DHODHPLA2G2ATRPV1CA9CA12 | |
| SCHEMBL6309512 | 0.72 | DHODH (0.73) | DHODHPLA2G2AKDM4ECYP2C9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113747920-A | Immune checkpoint inhibitor combination therapy using quinoline carboxamide derivatives | 株式会社益力多本社 | 2021-12-03 | — | — | CN | disclosed |
| CN-112703001-A | Combination cancer therapy using quinoline carboxamide derivatives | 株式会社益力多本社 | 2021-04-23 | — | — | CN | disclosed |