Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | CTSS | P25774 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22982779 | 1.00 | CYP3A4 (0.49) | CYP3A4TSHRATMALDH1A1CYP2C9 | |
| SCHEMBL20993378 | 0.87 | KMT2A (0.47) | CYP3A4TSHRALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL2342652 | 0.84 | CTSK (0.51) | ATMALDH1A1CTSLCTSSCASP1 | |
| SCHEMBL3414548 | 0.84 | CTSK (0.51) | ATMALDH1A1CTSLCTSSCASP1 | |
| SCHEMBL8382243 | 0.83 | FAAH (0.46) | ALDH1A1CYP2C19CYP1A2POLBKMT2A | |
| SCHEMBL6958944 | 0.83 | ATM (0.54) | CYP3A4TSHRATMALDH1A1CYP2C9 | |
| SCHEMBL16201457 | 0.83 | ATM (0.54) | CYP3A4TSHRATMALDH1A1CYP2C9 | |
| SCHEMBL4125738 | 0.83 | KMT2A (0.48) | TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL7285800 | 0.82 | ATM (0.55) | CYP3A4TSHRATMALDH1A1CYP2C9 | |
| SCHEMBL6156731 | 0.82 | CASP1 (0.60) | ATMALDH1A1CYP1A2CTSLCTSS |
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 |
|---|---|---|---|---|---|---|---|
| EP-0361341-A2 | Therapeutics for aids based on inhibitors of HIV protease | MILES INC. (US) | 1990-04-04 | — | — | EP | disclosed |