Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | NQO1 | P15559 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30236776 | 1.00 | CYP3A4 (0.48) | CYP3A4HPRT1ALDH1A1KDM4ENQO1 | |
| SCHEMBL1996656 | 0.80 | MAPT (0.57) | CYP3A4ALDH1A1KDM4ENQO1SOS2 | |
| SCHEMBL75226 | 0.78 | GRM5 (0.53) | CYP3A4ALDH1A1KDM4ENQO1SOS2 | |
| SCHEMBL29359679 | 0.78 | GRM5 (0.53) | CYP3A4ALDH1A1KDM4ENQO1SOS2 | |
| SCHEMBL27416745 | 0.78 | GRM5 (0.53) | CYP3A4ALDH1A1KDM4ENQO1SOS2 | |
| SCHEMBL3341584 | 0.77 | SOS2 (0.59) | HPRT1ALDH1A1KDM4ENQO1HSD17B10 | |
| Hydrochloric Acid SCHEMBL28328423 | 0.76 | GRM5 (0.52) | CYP3A4ALDH1A1KDM4ENQO1HSD17B10 | |
| Methane SCHEMBL27560165 | 0.76 | GRM5 (0.52) | CYP3A4ALDH1A1KDM4ENQO1SOS2 | |
| SCHEMBL17422696 | 0.76 | LMNA (0.59) | CYP3A4ALDH1A1KDM4ENQO1TSHR | |
| Ethylene SCHEMBL4594450 | 0.75 | GRM5 (0.50) | CYP3A4ALDH1A1KDM4ENQO1SOS2 |
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-2014011540-A1 | BONE MORPHOGENETIC PROTEIN PATHWAY ACTIVATION, COMPOSITIONS FOR OSSIFICATION, AND METHODS RELATED THERETO | EMORY UNIVERSITY (US) | 2014-01-16 | — | — | WO | disclosed |