Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL669469 | 0.98 | CYP2A6 (0.40) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL668822 | 0.85 | ALDH1A1 (0.42) | ALDH1A1TSHRHSD17B10MAPK1L3MBTL1 | |
| SCHEMBL668681 | 0.85 | MAPT (0.42) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL646330 | 0.84 | ALDH1A1 (0.42) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL9614637 | 0.81 | ALDH1A1 (0.50) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL8434859 | 0.81 | CYP2A6 (0.50) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL17136293 | 0.81 | ALDH1A1 (0.36) | CYP1A2ALDH1A1TSHRHSD17B10MAPK1 | |
| SCHEMBL18957552 | 0.81 | KDM4E (0.38) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL3841865 | 0.81 | CYP1A2 (0.50) | CYP1A2ALDH1A1HSD17B10L3MBTL1HPGD | |
| SCHEMBL578393 | 0.80 | ALDH1A1 (0.39) | CYP2A6CYP1A2ALDH1A1TSHRHSD17B10 |
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-2770008-B1 | POLYCARBONATE-POLYORGANOSILOXANE COPOLYMER AND METHOD FOR PRODUCING SAME | IDEMITSU KOSAN CO (JP) | 2016-11-30 | — | — | EP | disclosed |