Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TDO2 | P48775 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11843051 | 0.74 | IDO1 (0.44) | IDO1GSK3BGAATDO2KMT2A | |
| SCHEMBL6243496 | 0.71 | IDO1 (0.46) | IDO1GSK3BGAATDO2MAPT | |
| SCHEMBL1455790 | 0.70 | IDO1 (0.58) | IDO1GSK3BGAATDO2MAPT | |
| SCHEMBL166517 | 0.67 | IDO1 (0.43) | IDO1GSK3BGAATDO2KMT2A | |
| SCHEMBL8181705 | 0.64 | IDO1 (0.50) | IDO1GSK3BGAATDO2KMT2A | |
| SCHEMBL11027848 | 0.64 | TDP1 (0.34) | MAPTALDH1A1 | |
| SCHEMBL9159527 | 0.64 | IDO1 (0.64) | IDO1GSK3BGAATDO2MAPT | |
| Benzyl Bromide SCHEMBL28476577 | 0.64 | IDO1 (0.40) | IDO1GSK3BGAATDO2KMT2A | |
| SCHEMBL9899738 | 0.64 | IDO1 (0.53) | IDO1GSK3BGAATDO2MAPT | |
| SCHEMBL10753453 | 0.63 | MAPT (0.54) | IDO1GAATDO2KMT2AMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3983242-A | TRANQUILIZERS, MUSCLE RELAXANTS, SEDATIVE-HYPNOTICS | SANDOZ, INC. (US) | 1976-09-28 | — | — | US | disclosed |
| US-3983242-A | TRANQUILIZERS, MUSCLE RELAXANTS, SEDATIVE-HYPNOTICS | SANDOZ, INC. (US) | 1976-09-28 | — | — | US | disclosed |
| US-3983242-A | TRANQUILIZERS, MUSCLE RELAXANTS, SEDATIVE-HYPNOTICS | SANDOZ, INC. (US) | 1976-09-28 | — | — | US | disclosed |