Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.35 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | PLOD1 | Q02809 | 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 | |
|---|---|---|---|---|
| SCHEMBL8459977 | 0.87 | ALDH1A1 (0.41) | KMT2ACYP2C19CYP3A4ALDH1A1ESR1 | |
| SCHEMBL3385292 | 0.69 | ALDH1A1 (0.36) | KDM4EKMT2ACYP1A2CYP2C19CYP2C9 | |
| SCHEMBL8458667 | 0.69 | KMT2A (0.51) | KMT2AALDH1A1MLYCDMEN1FFAR1 | |
| SCHEMBL9482262 | 0.69 | CHEK1 (0.37) | KDM4EKMT2ACYP1A2CYP2C19TSHR | |
| SCHEMBL8458616 | 0.68 | ALDH1A1 (0.40) | KMT2ACYP1A2CYP2C19CYP2C9TSHR | |
| SCHEMBL11193576 | 0.67 | ALDH1A1 (0.37) | CYP3A4ALDH1A1ESR1ESR2HPGD | |
| SCHEMBL7401269 | 0.66 | CYP1A2 (0.47) | KDM4EKMT2ACYP1A2CYP2C19CYP2C9 | |
| SCHEMBL28773067 | 0.66 | ALDH1A1 (0.45) | KDM4EKMT2ACYP1A2CYP2C19CYP2C9 | |
| SCHEMBL5710878 | 0.66 | HPGD (0.56) | KDM4EKMT2ANAPRTUSP2ALDH1A1 | |
| SCHEMBL12999256 | 0.66 | KDM4E (0.50) | KDM4EKMT2ACYP1A2CYP2C19CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5962521-A | PROSTATE GLANDS DISORDERS | GUILFORD PHARMACEUTICALS INC. (US) | 1999-10-05 | — | — | US | disclosed |