Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 2/20 | 0.38 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21153819 | 1.00 | OPRM1 (0.46) | OPRM1TSHRSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL17414692 | 1.00 | OPRM1 (0.46) | OPRM1TSHRSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL11078227 | 0.88 | OPRM1 (0.53) | OPRM1TSHRSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL11078230 | 0.88 | OPRM1 (0.53) | OPRM1TSHRSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL17414156 | 0.82 | CCR2 (0.42) | SLC6A3SLC6A4SLC6A2CCR2ADAM17 | |
| SCHEMBL15978574 | 0.82 | OPRM1 (0.41) | OPRM1KDM4EALDH1A1MAPTHTT | |
| SCHEMBL17792929 | 0.80 | ALDH1A1 (0.47) | OPRM1TSHRKDM4EALDH1A1SLC6A3 | |
| SCHEMBL15977299 | 0.75 | MEN1 (0.40) | TSHRSMN1; SMN2ALDH1A1MAPTMAPK1 | |
| SCHEMBL3984092 | 0.73 | ADAM17 (0.53) | SLC6A3SLC6A4CCR2ADAM17 | |
| SCHEMBL11076991 | 0.73 | OPRM1 (0.50) | OPRM1TSHRSMN1; SMN2MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-10208322-B2 | In vivo and in vitro olefin cyclopropanation catalyzed by heme enzymes | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2019-02-19 | — | — | US | disclosed |
| US-20170247725-A1 | IN VIVO AND IN VITRO OLEFIN CYCLOPROPANATION CATALYZED BY HEME ENZYMES | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2017-08-31 | — | — | US | disclosed |