Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 7/20 | 0.82 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.82 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | LCK | P06239 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | NQO2 | P16083 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | HTR2C | P28335 | 2/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.55 |
| ▸ | MGAM | O43451 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | SI | P14410 | 1/20 | 0.55 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL24623214 | 0.87 | MTNR1A (0.64) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL22632087 | 0.85 | CYP2D6 (0.76) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL22632226 | 0.82 | MTNR1B (0.60) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL6439485 | 0.82 | KDM4E (0.69) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL28381712 | 0.81 | KDM4E (0.64) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL24623215 | 0.81 | CYP2D6 (0.63) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL14473750 | 0.81 | KDM4E (0.76) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL12221062 | 0.81 | KDM4E (0.80) | KDM4EALDH1A1HPGDLCKCYP2D6 | |
| SCHEMBL22632228 | 0.81 | MTNR1A (0.58) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL15984893 | 0.80 | KDM4E (0.71) | KDM4EALDH1A1HPGDLCKCYP2D6 |
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-2020223174-A1 | COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER | HEALTH RESEARCH, INC. (US) | 2020-11-05 | — | — | WO | disclosed |