Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ARG1 | P05089 | 1/20 | 0.33 |
| ▸ | ARG2 | P78540 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.30 |
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 SCHEMBL29492459 | 0.67 | NOS1 (0.54) | NOS3NOS1NOS2MEN1ALDH1A1 | |
| SCHEMBL58260 | 0.65 | — | — | |
| SCHEMBL6161347 | 0.65 | CA12 (0.56) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL6164956 | 0.65 | KIF11 (0.37) | ALDH1A1ARG1ARG2CA12CA1 | |
| Hydrochloric Acid SCHEMBL1133986 | 0.63 | MEN1 (0.62) | NOS3NOS1NOS2MEN1ALDH1A1 | |
| SCHEMBL1662958 | 0.63 | MEN1 (0.47) | NOS3NOS1NOS2MEN1ALDH1A1 | |
| SCHEMBL9818358 | 0.63 | MEN1 (0.47) | NOS3NOS1NOS2MEN1ALDH1A1 | |
| Acetic Acid SCHEMBL103302 | 0.61 | MEN1 (0.60) | NOS3NOS1NOS2MEN1ALDH1A1 | |
| SCHEMBL1651824 | 0.60 | — | — | |
| SCHEMBL5323365 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6162807-A | Thio acid derived monocyclic N-heterocyclics as anticoagulants | BERLEX LABORATORIES, INC. (US) | 2000-12-19 | — | — | US | disclosed |