Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP8B1 | Q9UNU6 | 3/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | SRPK2 | P78362 | 1/20 | 0.40 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.40 |
| ▸ | SRPK3 | Q9UPE1 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4743063 | 0.88 | THRB (0.56) | THRBMAPTSMN1; SMN2ALDH1A1HSD17B10 | |
| SCHEMBL4743443 | 0.88 | THRB (0.53) | THRBSMN1; SMN2ALDH1A1CYP8B1ADRB2 | |
| SCHEMBL4739993 | 0.82 | THRB (0.54) | THRBMAPTSMN1; SMN2CYP8B1HPGD | |
| SCHEMBL3887756 | 0.77 | ALDH1A1 (0.46) | THRBALDH1A1KDRCSF1RKDM4E | |
| SCHEMBL30592902 | 0.77 | ALDH1A1 (0.46) | THRBALDH1A1KDRCSF1RKDM4E | |
| Hydrochloric Acid SCHEMBL11870232 | 0.76 | ALDH1A1 (0.45) | THRBALDH1A1KDRCSF1RKDM4E | |
| SCHEMBL438818 | 0.76 | ALDH1A1 (0.53) | THRBALDH1A1KDRCSF1RKDM4E | |
| SCHEMBL4466003 | 0.76 | SORT1 (0.46) | THRBALDH1A1KDRCSF1RKDM4E | |
| SCHEMBL1644467 | 0.76 | THRB (0.46) | THRBALDH1A1KDRCSF1RKDM4E | |
| SCHEMBL4741630 | 0.74 | THRB (0.46) | THRBMAPTSMN1; SMN2CYP8B1CCNC |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008093940-A1 | QUINOLINE DERIVATIVES AS CASPASE-3 INHIBITOR, PREPARATION PROCESS FOR THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | YUNGJIN PHARMACEUTICAL CO., LTD. (KR) | 2008-08-07 | — | — | WO | disclosed |