Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.50 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.50 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.50 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.48 |
| ▸ | XIAP | P98170 | 1/20 | 0.48 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL333141 | 0.97 | CYP3A4 (0.55) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL29387256 | 0.97 | CYP3A4 (0.55) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL357669 | 0.91 | CYP3A4 (0.72) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL23534173 | 0.89 | AKR1C3 (0.63) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL7144398 | 0.89 | CYP3A4 (0.50) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL109890 | 0.86 | CYP3A4 (0.52) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL3358950 | 0.86 | SPR (0.56) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL16168317 | 0.85 | CYP3A4 (0.61) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL27901506 | 0.85 | TSHR (0.55) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 | |
| SCHEMBL2230263 | 0.84 | CYP3A4 (0.50) | CYP3A4CYP2C9KMT2AHPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4781862-A | Process for the preparation of anthraquinone | MONTVALE PROCESS COMPANY, INC. (US) | 1988-11-01 | — | — | US | disclosed |
| US-4666632-A | Process for the preparation of anthraquinone | THE HALCON SD GROUP, INC. (US) | 1987-05-19 | — | — | US | disclosed |