Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.55 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.55 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | FOXM1 | Q08050 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10398571 | 0.90 | CYP1A2 (0.50) | TAOK1TAOK3LTA4HKMT2AMEN1 | |
| SCHEMBL10399481 | 0.87 | GRIN1 (0.54) | TAOK1TAOK3GRIN2BSIGMAR1KMT2A | |
| SCHEMBL10400090 | 0.85 | KDM1A (0.52) | TAOK1TAOK3GRIN2BCYP1A2CYP2C19 | |
| SCHEMBL12614692 | 0.83 | LTA4H (0.55) | LTA4HKMT2AMEN1CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL27903791 | 0.82 | LTA4H (0.54) | LTA4HKMT2AMEN1CYP1A2CYP2C19 | |
| SCHEMBL10399740 | 0.81 | ALDH1A1 (0.47) | TAOK1TAOK3LTA4HCYP1A2CYP2C19 | |
| SCHEMBL4043115 | 0.80 | GRIN2B (0.57) | GRIN2BSIGMAR1 | |
| SCHEMBL10399771 | 0.79 | AR (0.50) | GRIN2BKMT2AMEN1RAB9AHRH3 | |
| Hydrochloric Acid SCHEMBL4053518 | 0.78 | GRIN2B (0.56) | GRIN2BSIGMAR1 | |
| SCHEMBL10399460 | 0.77 | MTNR1A (0.51) | GRIN2BSIGMAR1 |
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-4975461-A | Enzymes/oxidoreductases/inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1990-12-04 | — | — | US | disclosed |