Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 9/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | KDM5C | P41229 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.41 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL18291540 | 0.79 | CXCR4 (0.46) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL20037955 | 0.79 | CXCR4 (0.46) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL20465102 | 0.79 | CXCR4 (0.54) | CXCR4MEN1KMT2AHRH3ALDH1A1 | |
| SCHEMBL20249218 | 0.79 | CXCR4 (0.43) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL20037457 | 0.79 | CXCR4 (0.43) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL21850860 | 0.78 | SCD (0.40) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL1089502 | 0.75 | CXCR4 (0.65) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL17996820 | 0.75 | CXCR4 (0.65) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL20160684 | 0.75 | CXCR4 (0.49) | CXCR4LMNASIGMAR1KDM5CKDM4C | |
| SCHEMBL20038507 | 0.74 | CXCR4 (0.44) | CXCR4LMNASIGMAR1KDM5CKDM4C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016194831-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | 帝人ファーマ株式会社 | 2016-12-08 | — | — | WO | disclosed |