Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25262749 | 0.86 | MAPT (0.40) | KMT2ACYP2C19MEN1CYP3A4CYP2C9 | |
| SCHEMBL235905 | 0.78 | NPC1 (0.47) | OPRM1DRD3ALDH1A1DRD2SIGMAR1 | |
| SCHEMBL235949 | 0.78 | NPC1 (0.47) | OPRM1DRD3ALDH1A1DRD2SIGMAR1 | |
| SCHEMBL233200 | 0.78 | NPC1 (0.47) | OPRM1DRD3ALDH1A1DRD2SIGMAR1 | |
| SCHEMBL235953 | 0.78 | NPC1 (0.47) | OPRM1DRD3ALDH1A1DRD2SIGMAR1 | |
| SCHEMBL235012 | 0.78 | NPC1 (0.47) | OPRM1DRD3ALDH1A1DRD2SIGMAR1 | |
| SCHEMBL14801949 | 0.76 | CYP2C9 (0.45) | KMT2ACYP2C19MEN1CYP3A4CYP2C9 | |
| SCHEMBL3321783 | 0.73 | HDAC3 (0.56) | KMT2AMEN1HDAC3HDAC1HDAC2 | |
| SCHEMBL28525204 | 0.71 | KMT2A (0.49) | KMT2AMEN1OPRM1DRD3DRD4 | |
| SCHEMBL27262221 | 0.71 | MAPT (0.47) | KMT2ACYP2C19CYP3A4HIF1AOPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118215651-A | Method for producing isocyanate compound, method for producing urethane compound, method for recovering amine compound, and isocyanate composition | 旭化成株式会社 | 2024-06-18 | — | — | CN | disclosed |