Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7030492 | 0.80 | DHFR (0.38) | CES1MAPTCYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL816043 | 0.74 | ALDH1A1 (0.55) | CES1MAPTCYP2A6TSHRCYP1A2 | |
| SCHEMBL3154760 | 0.74 | CES1 (0.41) | CES1MAPTCYP2A6TSHRCYP1A2 | |
| SCHEMBL5689656 | 0.69 | KDM4E (0.38) | CES1MAPTCYP2A6TSHRALDH1A1 | |
| SCHEMBL7106902 | 0.69 | CES1 (0.37) | CES1MAPTCYP2A6TSHRCYP1A2 | |
| SCHEMBL4623136 | 0.67 | PDCD1 (0.40) | MAPTCYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL214275 | 0.66 | DNMT1 (0.46) | CES1MAPTCYP2A6TSHRCYP1A2 | |
| SCHEMBL21248065 | 0.66 | CES1 (0.56) | CES1MAPTCYP2A6TSHRCYP1A2 | |
| SCHEMBL29352216 | 0.65 | TSHR (0.65) | MAPTCYP2A6TSHRCYP1A2ALDH1A1 | |
| SCHEMBL2951616 | 0.65 | TSHR (0.65) | MAPTCYP2A6TSHRCYP1A2ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1053263-B1 | CATALYST SYSTEM | BASELL POLYOLEFINE GMBH (DE) | 2003-10-01 | — | — | EP | claimed |
| EP-1219657-B1 | POLYARYLENE AND METHOD FOR PRODUCTION THEREOF | JAPAN SCIENCE & TECH AGENCY (JP) | 2008-03-19 | — | — | EP | disclosed |
| EP-1219657-A1 | POLYARYLENE AND METHOD FOR PRODUCTION THEREOF | Japan Science and Technology Corporation (JP) | 2002-07-03 | — | — | EP | disclosed |
| US-20020052446-A1 | Composition based on monofluorometal complexes | BAYER AKTIENGESELLSCHAFT (DE) | 2002-05-02 | — | — | US | disclosed |
| US-5965678-A | Catalyst system based on monoazadiene metal complexes | BAYER AG (DE) | 1999-10-12 | — | — | US | disclosed |