Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 10/20 | 0.51 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8835392 | 0.88 | GRIN1 (0.55) | GRIN1CYP1A2 | |
| SCHEMBL8835573 | 0.87 | ALOX15 (0.46) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL4341047 | 0.85 | ALDH1A1 (0.48) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL8545149 | 0.83 | ALDH1A1 (0.49) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL8539658 | 0.81 | ALDH1A1 (0.48) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL8835577 | 0.79 | ALOX15 (0.45) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL8540435 | 0.79 | TP53 (0.48) | ALOX15ALDH1A1CYP1A2HPGDXBP1 | |
| SCHEMBL8538422 | 0.78 | ALDH1A1 (0.44) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL8835655 | 0.78 | ALDH1A1 (0.48) | ALOX15GRIN1ALDH1A1CYP1A2HPGD | |
| SCHEMBL8543504 | 0.78 | ALOX15 (0.47) | ALOX15ALDH1A1CYP1A2HPGDXBP1 |
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-5703107-A | CENTRAL NERVOUS SYSTEM DISORDERS; ANALGESICS; ANTIEPILEPTIC AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1997-12-30 | — | — | US | disclosed |
| US-5675018-A | 3-amidoindolyl derivatives | MERRELL PHARMACEUTICALS INC. (US) | 1997-10-07 | — | — | US | disclosed |