Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | IKZF3 | Q9UKT9 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.38 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11087738 | 1.00 | KDM4E (0.42) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL9059276 | 0.76 | ALDH1A1 (0.49) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL9059282 | 0.76 | ALDH1A1 (0.49) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL9059272 | 0.76 | ALDH1A1 (0.49) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL10739034 | 0.75 | ALDH1A1 (0.44) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL10739052 | 0.75 | ALDH1A1 (0.44) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL10739044 | 0.75 | ALDH1A1 (0.44) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL11210155 | 0.72 | TAS2R8 (0.38) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL8844240 | 0.71 | ALDH1A1 (0.41) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 | |
| SCHEMBL11477485 | 0.71 | DDB1 (0.41) | KDM4EALDH1A1CYP1A2CHRM2OPRM1 |
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-0101598-A1 | Beta-lactams | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-02-29 | — | — | EP | disclosed |