Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TLR2 | O60603 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.36 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.36 |
| ▸ | GGT1 | P19440 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
| ▸ | FNTB | P49356 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9115230 | 0.92 | NOD1 (0.41) | NOD1TLR2DPP7CA2FOLH1 | |
| SCHEMBL2762951 | 0.88 | FOLH1 (0.39) | NOD1TLR2FOLH1C3AR1GGT1 | |
| SCHEMBL6429710 | 0.85 | NOD1 (0.49) | NOD1TLR2DPP7FOLH1C3AR1 | |
| SCHEMBL1343491 | 0.85 | NOD1 (0.49) | NOD1TLR2DPP7FOLH1C3AR1 | |
| SCHEMBL9115471 | 0.85 | C3AR1 (0.36) | NOD1NPC1FOLH1C3AR1GGT1 | |
| SCHEMBL9185444 | 0.82 | NOD1 (0.55) | NOD1TLR2DPP7FOLH1C3AR1 | |
| SCHEMBL9185434 | 0.82 | NOD1 (0.55) | NOD1TLR2DPP7FOLH1C3AR1 | |
| SCHEMBL146216 | 0.82 | NOD1 (0.56) | NOD1CA2FOLH1GGT1 | |
| SCHEMBL8415545 | 0.82 | NOD1 (0.56) | NOD1CA2FOLH1GGT1 | |
| SCHEMBL1504531 | 0.81 | FOLH1 (0.38) | NOD1FOLH1C3AR1 |
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-1995013804-A1 | S-ALKYL-ISOTHIOUREIDO-AMINO ACIDS AND USE THEREOF | THE MEDICAL COLLEGE OF WISCONSIN RESEARCH FOUNDATION, INC. (US) | 1995-05-26 | — | — | WO | disclosed |