Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 17/20 | 0.50 |
| ▸ | CA2 | P00918 | 17/20 | 0.50 |
| ▸ | CA4 | P22748 | 9/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13004656 | 0.94 | CA2 (0.46) | TDP1KDM4ELMNACHRM2ADRA2A | |
| SCHEMBL9393098 | 0.93 | CA1 (0.41) | TDP1KDM4ELMNACHRM2ADRA2A | |
| SCHEMBL15159307 | 0.92 | CA1 (0.45) | TDP1KDM4ELMNACHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL8911995 | 0.90 | CA1 (0.43) | TDP1KDM4ELMNACHRM2ADRA2A | |
| SCHEMBL15499780 | 0.89 | TDP1 (0.56) | TDP1KDM4ELMNACHRM2ADRA2A | |
| SCHEMBL21539283 | 0.89 | TDP1 (0.56) | TDP1KDM4ELMNACHRM2ADRA2A | |
| SCHEMBL8719328 | 0.89 | TDP1 (0.56) | TDP1KDM4ELMNACHRM2ADRA2A | |
| Water SCHEMBL8536223 | 0.88 | TDP1 (0.54) | TDP1KDM4ELMNACHRM2ADRA2A | |
| SCHEMBL9394285 | 0.86 | PAOX (0.50) | KDM4ELMNACA1CA2CA4 | |
| SCHEMBL8536277 | 0.85 | TDP1 (0.65) | TDP1KDM4ELMNACHRM2ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-9737621-B2 | MRI-visible hydrophobic copolymer | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2017-08-22 | — | — | US | disclosed |