Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TCF4 | P15884 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17804346 | 0.82 | DHODH (0.44) | CYP1A2FBP1ALDH1A1TSHRTDP1 | |
| SCHEMBL31062952 | 0.80 | TSHR (0.56) | CYP1A2FBP1ALDH1A1TSHRTDP1 | |
| SCHEMBL2591086 | 0.80 | TSHR (0.56) | CYP1A2FBP1ALDH1A1TSHRTDP1 | |
| SCHEMBL13468174 | 0.80 | CYP1A2 (0.47) | CYP1A2ALDH1A1TSHRTDP1IMPDH2 | |
| SCHEMBL21543970 | 0.79 | ALDH1A1 (0.52) | CYP1A2ALDH1A1TDP1HPGDSMN1; SMN2 | |
| SCHEMBL23985882 | 0.78 | CYP1A2 (0.46) | CYP1A2ALDH1A1TSHRTDP1IMPDH2 | |
| SCHEMBL3939940 | 0.77 | PDGFRB (0.49) | CYP1A2ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL18830210 | 0.76 | TSHR (0.64) | CYP1A2ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL17804333 | 0.75 | TDP1 (0.43) | CYP1A2ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL5201165 | 0.75 | CYP1A2 (0.61) | CYP1A2ALDH1A1TSHRTDP1RECQL |
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 |