Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | LSS | P48449 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.47 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.47 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4884441 | 1.00 | HPGD (0.50) | HPGDLSSKDM4ECYP3A4CYP2D6 | |
| SCHEMBL28269086 | 0.83 | LSS (0.66) | HPGDLSSKDM4ECYP3A4CYP2D6 | |
| SCHEMBL8356766 | 0.81 | HRH3 (0.68) | CYP3A4MEN1KMT2APOLBHRH3 | |
| SCHEMBL4726 | 0.80 | SIGMAR1 (0.68) | MEN1KMT2APOLBSIGMAR1 | |
| SCHEMBL3994683 | 0.79 | HRH3 (0.67) | HPGDLSSKDM4ECYP3A4CYP2D6 | |
| SCHEMBL8099601 | 0.79 | CHRNB2 (0.70) | KDM4EDRD2ALDH1A1OPRL1CASP1 | |
| SCHEMBL1830945 | 0.79 | CHRNB2 (0.70) | KDM4EDRD2ALDH1A1OPRL1CASP1 | |
| SCHEMBL941871 | 0.78 | KDM4E (0.62) | LSSKDM4EMEN1KMT2AHRH3 | |
| Hydrochloric Acid SCHEMBL5671727 | 0.78 | SIGMAR1 (0.65) | MEN1KMT2APOLBSIGMAR1 | |
| Iodide SCHEMBL1697595 | 0.78 | SIGMAR1 (0.65) | MEN1KMT2APOLBSIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1056744-A1 | 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES | Aventis Pharmaceuticals Inc. (US) | 2000-12-06 | — | — | EP | disclosed |
| WO-1999043675-A1 | 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES | AVENTIS PHARMACEUTICALS INC. (US) | 1999-09-02 | — | — | WO | disclosed |