Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRAS | P01112 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | TOP1 | P11387 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 4/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL20527335 | 0.86 | LMNA (0.44) | POLBRXFP1MAPTCCNCCDK8 | |
| SCHEMBL25862247 | 0.85 | TOP1 (0.46) | HRASESR1TOP1ESR2POLB | |
| SCHEMBL21451882 | 0.84 | PTPN1 (0.46) | POLBMAPTCCNCCDK8NPSR1 | |
| Hydrochloric Acid SCHEMBL20527158 | 0.83 | PTPN1 (0.44) | POLBMAPTCCNCCDK8NPSR1 | |
| SCHEMBL18574371 | 0.82 | RXFP1 (0.42) | RXFP1KDM4EMAPTCCNCCDK8 | |
| Hydrochloric Acid SCHEMBL30944505 | 0.81 | RXFP1 (0.41) | RXFP1KDM4EMAPTCCNCCDK8 | |
| SCHEMBL18976172 | 0.77 | AR (0.46) | POLBRXFP1MAPTTHRBLMNA | |
| SCHEMBL19739146 | 0.77 | HRAS (0.41) | HRASESR1TOP1ESR2POLB | |
| SCHEMBL20086571 | 0.76 | KDM1A (0.51) | POLBMAPTTHRBLMNATP53 | |
| SCHEMBL15529221 | 0.76 | PLAU (0.45) | POLBRXFP1KDM4EMAPTCCNC |
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-2017098257-A1 | PBD ANTIBACTERIAL AGENTS | KING'S COLLEGE LONDON (GB) | 2017-06-15 | — | — | WO | disclosed |