Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2696410 | 0.93 | MEN1 (0.36) | CYP1A2CYP2C19CYP2C9PTGS2TDP1 | |
| SCHEMBL2697773 | 0.93 | CYP1A2 (0.36) | CYP1A2CYP2C19CYP2C9PTGS2TDP1 | |
| SCHEMBL2696899 | 0.86 | KMT2A (0.35) | CYP1A2CYP2C19CYP2C9PTGS2TDP1 | |
| SCHEMBL2694774 | 0.86 | HTR1B (0.44) | TSHRKMT2AMEN1RAB9ASMN1; SMN2 | |
| SCHEMBL2695743 | 0.83 | APLNR (0.36) | CYP1A2CYP2C19CYP2C9PTGS2TSHR | |
| SCHEMBL2694303 | 0.83 | KDM4E (0.33) | CYP1A2CYP2C19CYP2C9PTGS2KDM4E | |
| SCHEMBL2697631 | 0.82 | TSHR (0.36) | CYP1A2CYP2C19CYP2C9PTGS2TSHR | |
| SCHEMBL2694696 | 0.82 | ALOX5 (0.39) | PTGS2TSHRKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL8398114 | 0.80 | TSHR (0.44) | CYP1A2CYP2C19CYP2C9PTGS2TSHR | |
| SCHEMBL2697610 | 0.80 | L3MBTL1 (0.43) | CYP1A2CYP2C19CYP2C9PTGS2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8168812-B2 | Process for producing alkyl tin alkoxide compound and process for producing carbonic acid ester using said compound | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2012-05-01 | — | — | US | disclosed |