Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CES2 | O00748 | 5/20 | 0.38 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.37 |
| ▸ | CES1 | P23141 | 4/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | PPARG | P37231 | 4/20 | 0.34 |
| ▸ | PPARD | Q03181 | 4/20 | 0.34 |
| ▸ | PPARA | Q07869 | 4/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.34 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.34 |
| ▸ | TLR2 | O60603 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL9550773 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2DNM1CES1FAAH | |
| SCHEMBL31055575 | 0.96 | ALDH1A1 (0.40) | ALDH1A1CES2DNM1CES1FAAH | |
| SCHEMBL9618988 | 0.93 | ALDH1A1 (0.44) | ALDH1A1CES2DNM1CES1FAAH | |
| SCHEMBL6361287 | 0.88 | ALDH1A1 (0.32) | ALDH1A1TSHRHSD17B10 | |
| SCHEMBL9005427 | 0.85 | ALDH1A1 (0.33) | ALDH1A1TSHRHSD17B10 | |
| SCHEMBL9741985 | 0.83 | TSHR (0.39) | ALDH1A1CA12CA1CA9TSHR | |
| SCHEMBL2771589 | 0.83 | ALDH1A1 (0.32) | ALDH1A1TSHRHSD17B10 | |
| Potassium SCHEMBL9155099 | 0.83 | ALDH1A1 (0.32) | ALDH1A1TSHRHSD17B10 | |
| SCHEMBL10427469 | 0.83 | ALDH1A1 (0.32) | ALDH1A1TSHRHSD17B10 | |
| SCHEMBL7213281 | 0.82 | AKR1B1 (0.41) | ALDH1A1CES2DNM1CES1AKR1B1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5132323-A | Treatment of animals | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1992-07-21 | — | — | US | disclosed |
| EP-0333756-B1 | 1,2-DIAMINOCYCLOHEXANE-PLATINUM COMPLEXES WITH ANTITUMOR ACTIVITY | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1992-01-15 | — | — | EP | disclosed |
| EP-0333756-A1 | 1,2-DIAMINOCYCLOHEXANE-PLATINUM COMPLEXES WITH ANTITUMOR ACTIVITY. | UNIV TEXAS (US) | 1989-09-27 | — | — | EP | disclosed |
| WO-1988003925-A1 | 1,2-DIAMINOCYCLOHEXANE-PLATINUM COMPLEXES WITH ANTITUMOR ACTIVITY | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1988-06-02 | — | — | WO | disclosed |