Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 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 | |
|---|---|---|---|---|
| SCHEMBL9745874 | 1.00 | ATM (0.43) | ATMALDH1A1TSHRHPGDHCAR2 | |
| SCHEMBL9743811 | 0.82 | CYP2D6 (0.44) | ALDH1A1HCAR2LMNACYP2C9CYP2C19 | |
| SCHEMBL9746246 | 0.80 | CYP2D6 (0.40) | ATMALDH1A1TSHRHPGDHCAR2 | |
| SCHEMBL9746256 | 0.80 | CYP2D6 (0.40) | ATMALDH1A1TSHRHPGDHCAR2 | |
| SCHEMBL345234 | 0.77 | ATM (0.50) | ATMALDH1A1TSHRHPGDHCAR2 | |
| SCHEMBL9468029 | 0.76 | NAAA (0.42) | ALDH1A1TSHRHCAR2MAPTLMNA | |
| SCHEMBL9468666 | 0.76 | NAAA (0.42) | ALDH1A1TSHRHCAR2MAPTLMNA | |
| SCHEMBL22281529 | 0.75 | TSHR (0.55) | ATMALDH1A1TSHRHPGDHCAR2 | |
| SCHEMBL9743034 | 0.75 | LAP3 (0.40) | CYP2C9CYP2C19NAAA | |
| SCHEMBL9743040 | 0.75 | LAP3 (0.40) | CYP2C9CYP2C19NAAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5175344-A | Anticonvulsants, anxiolytic agents | CIBA-GEIGY CORPORATION (US) | 1992-12-29 | — | — | US | disclosed |
| US-5051413-A | For treatment of ischemia, antispasmodic agents, anticonvulsants and anxiety or manic conditions | CIBA-GEIGY CORPORATION (US) | 1991-09-24 | — | — | US | disclosed |