Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PNLIP | P16233 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PARG | Q86W56 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3719884 | 0.90 | ESRRA (0.51) | ESRRAKDM4EMAPTKMT2ATDP1 | |
| SCHEMBL3719330 | 0.86 | ESRRA (0.60) | ESRRAMAPTALDH1A1HPGDGAA | |
| SCHEMBL3719235 | 0.86 | MEN1 (0.58) | ESRRAMAPTKMT2AALDH1A1HPGD | |
| SCHEMBL3726992 | 0.85 | ESRRA (0.53) | ESRRAKDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL3720205 | 0.84 | ESRRA (0.52) | ESRRAKDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL29793856 | 0.83 | KDM4E (0.72) | KDM4EMAPTKMT2ATDP1ALDH1A1 | |
| SCHEMBL246511 | 0.83 | KDM4E (0.72) | KDM4EMAPTKMT2ATDP1ALDH1A1 | |
| SCHEMBL3727616 | 0.81 | ESRRA (0.52) | ESRRAKDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL3717394 | 0.81 | HDAC8 (0.44) | ESRRAKDM4EMAPTALDH1A1HPGD | |
| SCHEMBL3721318 | 0.80 | ESRRA (0.48) | ESRRAKDM4EMAPTKMT2ATDP1 |
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-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |