Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 1/20 | 0.65 |
| ▸ | TDO2 | P48775 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | BCR | P11274 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3455245 | 0.83 | ABL1 (0.60) | TDO2ABL1ABCB1BCRMAOB | |
| SCHEMBL14528680 | 0.81 | FABP4 (0.55) | FABP4ABL1MMP9MAOBNPC1 | |
| SCHEMBL2020140 | 0.79 | ABL1 (0.59) | TDO2ABL1ABCB1BCRMAOB | |
| SCHEMBL14528589 | 0.79 | FABP4 (0.67) | FABP4MAOBSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL13211663 | 0.76 | ABL1 (0.60) | TDO2ABL1ABCB1BCRMAOB | |
| SCHEMBL14528516 | 0.75 | FABP4 (0.60) | FABP4ADORA2AADORA1F2 | |
| SCHEMBL14450976 | 0.72 | ALDH1A1 (0.51) | MAOBNPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL14528686 | 0.72 | FABP4 (0.53) | FABP4MMP9RAB9ATDP1KDM4E | |
| SCHEMBL10023268 | 0.72 | ACHE (0.64) | TDO2ABL1ABCB1BCRMAOB | |
| SCHEMBL2876291 | 0.70 | CLK4 (0.56) | TDO2ABL1ABCB1BCRMAOB |
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-1181014-B1 | HETEROCYCLIC CONTAINING BIPHENYL aP2 INHIBITORS AND METHOD | BRISTOL MYERS SQUIBB CO (US) | 2007-05-23 | — | — | EP | disclosed |