Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.51 |
| ▸ | NOS1 | P29475 | 2/20 | 0.51 |
| ▸ | HTR1D | P28221 | 3/20 | 0.41 |
| ▸ | HTR1B | P28222 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8709283 | 0.99 | NOS3 (0.52) | NOS3NOS1HTR1DHTR1BMAOA | |
| SCHEMBL8381681 | 0.94 | NOS3 (0.47) | NOS3NOS1HTR1DHTR1BMAPT | |
| SCHEMBL8382171 | 0.89 | NOS3 (0.44) | NOS3NOS1HTR1DHTR1BMAPT | |
| SCHEMBL8382960 | 0.88 | NOS3 (0.46) | NOS3NOS1MAOAMAOBMAPT | |
| SCHEMBL8381682 | 0.88 | NOS3 (0.44) | NOS3NOS1HTR1DHTR1BMAPT | |
| SCHEMBL8381630 | 0.87 | NOS1 (0.46) | NOS3NOS1HTR1DHTR1BMAPT | |
| SCHEMBL8386551 | 0.86 | NOS3 (0.54) | NOS3NOS1HTR1DHTR1BMAPT | |
| Hydrochloric Acid SCHEMBL8386484 | 0.85 | NOS3 (0.56) | NOS3NOS1HTR1DHTR1BMAPT | |
| SCHEMBL8387495 | 0.85 | NOS3 (0.46) | NOS3NOS1HTR1DHTR1BMAPT | |
| SCHEMBL8386627 | 0.85 | NOS3 (0.41) | NOS3NOS1HTR1DHTR1BMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998046570-A1 | SUBSTITUTED HETEROAROMATIC 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |