Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.62 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.55 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL16335361 | 0.81 | SIGMAR1 (0.75) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL22528263 | 0.81 | SIGMAR1 (0.79) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL20145479 | 0.80 | HTR1A (0.80) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL16335245 | 0.80 | SIGMAR1 (0.73) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL29411058 | 0.79 | SIGMAR1 (0.75) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL10567058 | 0.78 | MEN1 (0.62) | SIGMAR1HTR1AGRIN2BTRPV1 | |
| Hydrochloric Acid SCHEMBL16335548 | 0.78 | SIGMAR1 (0.73) | SIGMAR1HTR1AGRIN2B | |
| Hydrochloric Acid SCHEMBL16335321 | 0.78 | SIGMAR1 (0.73) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL22528260 | 0.77 | SIGMAR1 (1.00) | SIGMAR1HTR1AGRIN2B | |
| SCHEMBL7245981 | 0.77 | DRD3 (0.68) | SIGMAR1HTR1AGRIN2B |
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-4766124-A | Beta-carbolin H1-receptor antagonists | AMERICAN HOME PRODUCTS CORPORATION (US) | 1988-08-23 | — | — | US | claimed |
| US-4663456-A | 2-(substituted piperazinylalkyl)β-carbolines useful in treatment of psychological disorders | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-05-05 | — | — | US | claimed |
| US-4766124-A | Beta-carbolin H1-receptor antagonists | AMERICAN HOME PRODUCTS CORPORATION (US) | 1988-08-23 | — | — | US | disclosed |
| US-4663456-A | 2-(substituted piperazinylalkyl)β-carbolines useful in treatment of psychological disorders | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-05-05 | — | — | US | disclosed |