Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | PARL | Q9H300 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7781846 | 0.91 | HSD11B1 (0.40) | HSD11B1USP2LMNAKDRKDM4E | |
| SCHEMBL6542587 | 0.79 | HSD11B1 (0.45) | HSD11B1PTGESUSP2LMNAKDM4E | |
| SCHEMBL7789463 | 0.76 | CA9 (0.40) | LMNAKDM4EALDH1A1GAAHPGD | |
| SCHEMBL6542734 | 0.72 | EDNRA (0.40) | HSD11B1PTGESUSP2LMNAKDR | |
| SCHEMBL6542004 | 0.70 | HSD11B1 (0.45) | HSD11B1USP2LMNAKDRKDM4E | |
| SCHEMBL6541763 | 0.67 | HSD11B1 (0.47) | HSD11B1PTGESUSP2KDM4EMAPK1 | |
| SCHEMBL6542415 | 0.67 | EDNRA (0.42) | HSD11B1USP2LMNAKDRALDH1A1 | |
| SCHEMBL6541984 | 0.65 | HTR1A (0.36) | HSD11B1PTGESLMNAHPGDELANE | |
| SCHEMBL6542420 | 0.64 | HSD11B1 (0.46) | HSD11B1PTGESUSP2LMNAKDR | |
| SCHEMBL6542645 | 0.62 | EDNRA (0.49) | USP2KDM4EALDH1A1GAAHPGD |
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-6252070-B1 | REACTING ARYL BROMIDE WITH BUTYLLITHIUM AND ZINC BROMIDE TO GIVE ARYL ZINC BROMIDE; REACTING WITH CORRESPONDING BENZOTHIAZINE COMPOUND | WARNER-LAMBERT COMPANY | 2001-06-26 | — | — | US | disclosed |