Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.48 |
| ▸ | ARG2 | P78540 | 4/20 | 0.44 |
| ▸ | ARG1 | P05089 | 3/20 | 0.44 |
| ▸ | DDAH1 | O94760 | 2/20 | 0.41 |
| ▸ | OTC | P00480 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 6/20 | 0.40 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | NOS3 | P29474 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL934762 | 1.00 | GSR (0.48) | GSRARG2ARG1DDAH1OTC | |
| Hydrochloric Acid SCHEMBL4581849 | 0.98 | GSR (0.47) | GSRARG2ARG1DDAH1OTC | |
| Hydrochloric Acid SCHEMBL4424849 | 0.98 | GSR (0.47) | GSRARG2ARG1DDAH1OTC | |
| Hydrochloric Acid SCHEMBL7977023 | 0.98 | GSR (0.47) | GSRARG2ARG1DDAH1OTC | |
| Hydrochloric Acid SCHEMBL7974008 | 0.98 | GSR (0.47) | GSRARG2ARG1DDAH1OTC | |
| SCHEMBL1504429 | 0.95 | GSR (0.46) | GSRARG2ARG1DDAH1OTC | |
| SCHEMBL4316097 | 0.95 | GSR (0.46) | GSRARG2ARG1DDAH1OTC | |
| SCHEMBL21067514 | 0.95 | GSR (0.46) | GSRARG2ARG1DDAH1OTC | |
| Hydrochloric Acid SCHEMBL8900288 | 0.93 | GSR (0.44) | GSRARG2ARG1DDAH1OTC | |
| Hydrochloric Acid SCHEMBL4057533 | 0.93 | GSR (0.44) | GSRARG2ARG1DDAH1OTC |
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-2001005748-A1 | OLIGOMERIC AMINO ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | MONSANTO COMPANY (US) | 2001-01-25 | — | — | WO | disclosed |