Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MAT2A | P31153 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR7 | P34969 | 2/20 | 0.31 |
| ▸ | HTR6 | P50406 | 2/20 | 0.31 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | APLNR | P35414 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733303 | 0.88 | ALDH1A1 (0.34) | ALDH1A1CYP2D6CYP2C19MAT2AHTR7 | |
| SCHEMBL9734328 | 0.87 | ALDH1A1 (0.34) | ALDH1A1CYP2D6CYP2C19MAT2AHIF1A | |
| SCHEMBL9733985 | 0.86 | ALDH1A1 (0.43) | ALDH1A1CYP2D6CYP2C19MAT2AMALT1 | |
| SCHEMBL9733280 | 0.85 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP2C19MAT2AHIF1A | |
| SCHEMBL9733681 | 0.74 | ALDH1A1 (0.45) | ALDH1A1CYP2D6CYP2C19MALT1KDM4E | |
| SCHEMBL9733850 | 0.73 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP2C19MALT1KDM4E | |
| SCHEMBL9733390 | 0.72 | ALDH1A1 (0.43) | ALDH1A1CYP2D6CYP2C19MALT1KDM4E | |
| SCHEMBL9733212 | 0.71 | ALDH1A1 (0.57) | ALDH1A1CYP2D6CYP2C19MAT2ASMN1; SMN2 | |
| SCHEMBL9734323 | 0.71 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP2C19HIF1AKDM4E | |
| SCHEMBL9733292 | 0.71 | MEN1 (0.45) | ALDH1A1CYP2D6CYP2C19HIF1ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5124331-A | Anticancer agents | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1992-06-23 | — | — | US | disclosed |
| EP-0364598-A1 | 3,4-dihydrothieno ¬2,3-d pyrimidine compounds and pharmaceutical application thereof | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1990-04-25 | — | — | EP | disclosed |