Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1232704 | 0.83 | CYP3A4 (0.66) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL14270880 | 0.83 | TSHR (0.41) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL26277306 | 0.83 | TSHR (0.41) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL12413758 | 0.80 | TSHR (0.42) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL16344910 | 0.80 | TSHR (0.42) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL730130 | 0.79 | ALDH1A1 (0.48) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL536410 | 0.79 | TSHR (0.34) | TSHRCYP3A4ATMTDP1HTT | |
| SCHEMBL1232706 | 0.78 | CYP3A4 (0.58) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL536397 | 0.78 | TSHR (0.39) | TSHRCYP3A4ATMTDP1RECQL | |
| SCHEMBL4439273 | 0.77 | TSHR (0.44) | TSHRCYP3A4ATMTDP1RECQL |
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-4464290-A | REMOVAL OF CONIFERYL BENZOATE AND ACETATE | SHISEIDO COMPANY LTD. (JP) | 1984-08-07 | — | — | US | disclosed |