Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SCN1A | P35498 | 1/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16307931 | 1.00 | HTT (0.40) | HTTHSD11B1EPHX2ATMALDH1A1 | |
| SCHEMBL18177915 | 0.86 | HTT (0.47) | HTTHSD11B1EPHX2ATMALDH1A1 | |
| SCHEMBL455945 | 0.84 | TP53 (0.36) | EPHX2ATMALDH1A1TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL1697515 | 0.81 | SMN1; SMN2 (0.38) | EPHX2ATMALDH1A1TSHRKDM4E | |
| SCHEMBL15922897 | 0.78 | TP53 (0.41) | HSD11B1ATMALDH1A1TSHRKDM4E | |
| SCHEMBL24720249 | 0.77 | HTT (0.36) | HTTHSD11B1EPHX2ATMALDH1A1 | |
| SCHEMBL1143530 | 0.72 | TP53 (0.41) | HSD11B1ATMALDH1A1TSHRTDP1 | |
| SCHEMBL11355878 | 0.69 | HSD11B1 (0.41) | HSD11B1ATMTSHRTDP1POLB | |
| SCHEMBL15922741 | 0.69 | TP53 (0.39) | HSD11B1ATMTSHRTDP1POLB | |
| SCHEMBL19073248 | 0.68 | TP53 (0.36) | ATMALDH1A1TSHRPOLBTP53 |
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-9938253-B2 | Catalysts for efficient Z-selective metathesis | TRUSTEES OF BOSTON COLLEGE (US) | 2018-04-10 | — | — | US | disclosed |