Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7102535 | 0.72 | ALDH1A1 (0.68) | BRD4MEN1CYP1A2KMT2AGAA | |
| SCHEMBL4851721 | 0.72 | SIGMAR1 (0.42) | BRD4KMT2ATSHRGAAALDH1A1 | |
| SCHEMBL8711235 | 0.68 | KMT2A (0.37) | MEN1CYP1A2KMT2APOLBTSHR | |
| SCHEMBL2637139 | 0.68 | GAA (0.53) | BRD4MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL9337866 | 0.67 | GAA (0.59) | BRD4MEN1KMT2AGAAALDH1A1 | |
| SCHEMBL7607750 | 0.66 | SMN1; SMN2 (0.48) | BRD4TSHRGAAALDH1A1LMNA | |
| SCHEMBL735234 | 0.66 | IDO1 (0.59) | TSHRGAAALDH1A1LMNAMAPT | |
| SCHEMBL26692976 | 0.66 | MEN1 (0.46) | MEN1KMT2AGAAALDH1A1OPRM1 | |
| SCHEMBL9666272 | 0.66 | BRD4 (0.38) | BRD4TSHRGAAALDH1A1OPRM1 | |
| SCHEMBL8368989 | 0.65 | OPRM1 (0.62) | GAAOPRM1OPRD1OPRK1SLC22A1 |
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-1998002432-A1 | BICYCLIC COMPOUNDS FOR CONTROLLING MICTURITION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-01-22 | — | — | WO | disclosed |