Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 1/20 | 0.55 |
| ▸ | LTA4H | P09960 | 2/20 | 0.45 |
| ▸ | BCL2 | P10415 | 1/20 | 0.44 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | BAD | Q92934 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | EDNRA | P25101 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | SENP5 | Q96HI0 | 1/20 | 0.42 |
| ▸ | SENP2 | Q9HC62 | 1/20 | 0.42 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4603385 | 0.91 | CXCR2 (0.53) | CXCR2LTA4HTSHRALDH1A1LMNA | |
| SCHEMBL4635068 | 0.88 | LMNA (0.51) | CXCR2ALDH1A1LMNAMAPTRXFP1 | |
| SCHEMBL4604985 | 0.83 | CXCR2 (0.54) | CXCR2LMNAFFAR1PPARGMAPT | |
| SCHEMBL4633866 | 0.83 | CXCR2 (0.67) | CXCR2BCL2BCL2L1MCL1BAD | |
| SCHEMBL4635016 | 0.82 | CXCR2 (0.43) | CXCR2LTA4HALDH1A1LMNAPPARG | |
| SCHEMBL4828979 | 0.80 | CXCR2 (0.57) | CXCR2LMNAFFAR1PPARG | |
| SCHEMBL4633030 | 0.80 | CXCR2 (0.52) | CXCR2LMNAFFAR1PPARG | |
| SCHEMBL13932451 | 0.80 | FFAR1 (0.60) | LTA4HLMNAFFAR1PPARGMAPT | |
| SCHEMBL4603395 | 0.80 | FFAR1 (0.53) | CXCR2LMNAFFAR1 | |
| SCHEMBL4635058 | 0.79 | CXCR2 (0.58) | CXCR2BCL2BCL2L1MCL1BAD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1685121-B1 | ANTIDIABETIC COMPOUNDS COMPRISING BENZOTHIOPHENE DERIVATIVES | MERCK PATENT GMBH (DE) | 2008-06-11 | — | — | EP | claimed |