Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OTC | P00480 | 1/20 | 0.56 |
| ▸ | GSR | P00390 | 1/20 | 0.53 |
| ▸ | DDAH1 | O94760 | 3/20 | 0.51 |
| ▸ | ARG2 | P78540 | 4/20 | 0.48 |
| ▸ | ARG1 | P05089 | 3/20 | 0.48 |
| ▸ | NOS2 | P35228 | 5/20 | 0.47 |
| ▸ | NOS1 | P29475 | 3/20 | 0.47 |
| ▸ | NOS3 | P29474 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8871251 | 0.98 | GSR (0.55) | OTCGSRDDAH1ARG2ARG1 | |
| SCHEMBL5279090 | 0.98 | GSR (0.55) | OTCGSRDDAH1ARG2ARG1 | |
| SCHEMBL9069162 | 0.98 | GSR (0.55) | OTCGSRDDAH1ARG2ARG1 | |
| SCHEMBL56915 | 0.98 | GSR (0.55) | OTCGSRDDAH1ARG2ARG1 | |
| SCHEMBL27798566 | 0.96 | GSR (0.53) | OTCGSRDDAH1ARG2ARG1 | |
| SCHEMBL21415550 | 0.96 | GSR (0.53) | OTCGSRDDAH1ARG2ARG1 | |
| Urea SCHEMBL20898440 | 0.96 | GSR (0.53) | OTCGSRDDAH1ARG2ARG1 | |
| L-Citrulline SCHEMBL4542892 | 0.96 | OTC (0.59) | OTCGSRDDAH1ARG2ARG1 | |
| L-Citrulline SCHEMBL22426116 | 0.96 | OTC (0.59) | OTCGSRDDAH1ARG2ARG1 | |
| L-Citrulline SCHEMBL215403 | 0.96 | OTC (0.59) | OTCGSRDDAH1ARG2ARG1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3129909-A1 | SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT | Metabolon, Inc. (US) | 2017-02-15 | — | — | EP | disclosed |
| WO-2015157407-A1 | SMALL MOLECULE BIOCHEMICAL PROFILING OF INDIVIDUAL SUBJECTS FOR DISEASE DIAGNOSIS AND HEALTH ASSESSMENT | METABOLON, INC. (US) | 2015-10-15 | — | — | WO | disclosed |