Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | PTPRF | P10586 | 2/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL16535026 | 0.84 | PIM1 (0.40) | CYP1B1CYP1A1PIM1IRAK4CYP1A2 | |
| SCHEMBL20197302 | 0.83 | SMN1; SMN2 (0.46) | CYP1B1CYP1A1CYP1A2CDK5CDK5R1 | |
| SCHEMBL20197340 | 0.80 | EIF4E (0.53) | CNR1CDK5CDK5R1KDM4ENPC1 | |
| SCHEMBL20197228 | 0.78 | CYP1A1 (0.42) | CYP1B1CYP1A1CYP1A2KDM4ENPC1 | |
| SCHEMBL20197350 | 0.78 | PIM1 (0.41) | CYP1B1CYP1A1PIM1IRAK4CYP1A2 | |
| SCHEMBL20197306 | 0.77 | PRKD1 (0.39) | KDM4EALDH1A1 | |
| SCHEMBL20197341 | 0.76 | CYP1B1 (0.35) | CYP1B1CYP1A1CYP1A2KDM4ESMN1; SMN2 | |
| SCHEMBL20197240 | 0.76 | ALDH1A1 (0.53) | CYP1B1CYP1A1CYP1A2KDM4ENPC1 | |
| SCHEMBL20197440 | 0.76 | KDM4E (0.36) | KDM4ENPC1CRHBPRAB9ACRHR2 | |
| SCHEMBL20197320 | 0.74 | SREBF2 (0.44) | KDM4ENPC1CRHBPRAB9ACRHR2 |
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-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |