Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TCF4 | P15884 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FASN | P49327 | 2/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL11285848 | 0.83 | ALDH1A1 (0.47) | CYP3A4TCF4CTNNB1TSHRTDP1 | |
| SCHEMBL15870998 | 0.81 | HPGD (0.53) | TCF4CTNNB1TSHRTDP1ALOX15 | |
| SCHEMBL17804333 | 0.80 | TDP1 (0.43) | TCF4CTNNB1TSHRTDP1ALOX15 | |
| SCHEMBL2081805 | 0.78 | NOS2 (0.65) | CYP3A4TSHRTDP1ALOX15ALDH1A1 | |
| SCHEMBL7447640 | 0.78 | ABL1 (0.56) | CYP3A4TSHRTDP1ALOX15ALDH1A1 | |
| SCHEMBL13468188 | 0.77 | CYP3A4 (0.50) | CYP3A4TDP1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL32685218 | 0.77 | KDM4E (0.66) | CYP3A4TDP1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL13280226 | 0.77 | KDM4E (0.66) | CYP3A4TDP1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL18830028 | 0.77 | ALDH1A1 (0.51) | CYP3A4TSHRALDH1A1HPGDHSD17B10 | |
| SCHEMBL17804340 | 0.76 | TSHR (0.40) | TCF4CTNNB1TSHRTDP1ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3165520-A1 | SUBSTITUTED BENZENE COMPOUNDS | Epizyme Inc (US) | 2017-05-10 | — | — | EP | disclosed |
| EP-2697198-B1 | SUBSTITUTED BENZENE COMPOUNDS | EPIZYME INC (US) | 2016-06-08 | — | — | EP | disclosed |