Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 9/20 | 0.71 |
| ▸ | GABRA5 | P31644 | 9/20 | 0.71 |
| ▸ | GABRA2 | P47869 | 9/20 | 0.71 |
| ▸ | GABRB2 | P47870 | 8/20 | 0.71 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.71 |
| ▸ | HPGD | P15428 | 4/20 | 0.71 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.71 |
| ▸ | BRD4 | O60885 | 2/20 | 0.71 |
| ▸ | LMNA | P02545 | 2/20 | 0.71 |
| ▸ | CNR1 | P21554 | 1/20 | 0.71 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.55 |
| ▸ | PTAFR | P25105 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11859304 | 0.87 | GABRA1 (0.60) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11874921 | 0.85 | GABRA1 (0.76) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11855387 | 0.85 | GABRA1 (0.53) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11623879 | 0.84 | GABRA1 (0.74) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11608547 | 0.84 | HPGD (0.65) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11356996 | 0.84 | HPGD (0.62) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11761784 | 0.84 | HPGD (0.62) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11380588 | 0.84 | OPRK1 (0.74) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL8250450 | 0.83 | GABRA1 (0.74) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| Alprazolam SCHEMBL8398 | 0.83 | GABRA1 (1.00) | GABRA1GABRA5GABRA2GABRB2GABRA3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3987052-A | SEDATIVES, TRANQUILIZERS, MUSCLE RELAXANTS | THE UPJOHN COMPANY (US) | 1976-10-19 | — | — | US | claimed |
| US-4075221-A | ALKYLATION WITH DIALKYLMETHYLENEAMMONIUM SALT IN PRESENCE OF REACTIVE CARBOXYLIC ACYLATING AGENT | THE UPJOHN COMPANY (US) | 1978-02-21 | — | — | US | disclosed |
| US-4000289-A | 6-PHENYL-4H-S-TRIAZOLO(4,3-A)(1,4)BENZODIAZEPINES | THE UPJOHN COMPANY (US) | 1976-12-28 | — | — | US | disclosed |
| US-3987052-A | SEDATIVES, TRANQUILIZERS, MUSCLE RELAXANTS | THE UPJOHN COMPANY (US) | 1976-10-19 | — | — | US | disclosed |