Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.72 |
| ▸ | FAAH | O00519 | 2/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | NOD1 | Q9Y239 | 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 | |
|---|---|---|---|---|
| SCHEMBL3272495 | 1.00 | ALDH1A1 (0.72) | ALDH1A1FAAHMCL1GAAMMP2 | |
| SCHEMBL26199542 | 1.00 | ALDH1A1 (0.72) | ALDH1A1FAAHMCL1GAAMMP2 | |
| SCHEMBL9226997 | 0.85 | FAAH (0.59) | ALDH1A1FAAHGAAKMT2ACAPN1 | |
| SCHEMBL8693439 | 0.84 | ALDH1A1 (0.50) | ALDH1A1FAAHMCL1MMP2MMP9 | |
| SCHEMBL16181357 | 0.83 | ALDH1A1 (0.80) | ALDH1A1FAAHMCL1GAAMMP2 | |
| SCHEMBL17915857 | 0.80 | FAAH (0.47) | ALDH1A1FAAHMCL1MMP2MMP9 | |
| SCHEMBL28744914 | 0.80 | FAAH (0.47) | ALDH1A1FAAHMCL1MMP2MMP9 | |
| SCHEMBL21935015 | 0.80 | GABRP (0.52) | ALDH1A1FAAHMCL1MMP2MMP9 | |
| SCHEMBL22175582 | 0.80 | FAAH (0.47) | ALDH1A1FAAHMCL1MMP2MMP9 | |
| SCHEMBL20734736 | 0.80 | ALDH1A1 (0.47) | ALDH1A1FAAHMCL1GAAMMP2 |
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-2023130008-A2 | PHARMACEUTICAL COMPOSITIONS OF 6-(2-(2H-TETRAZOL-5-YL)ETHYL)DECAHYDROISOQUINOLINE-3-CARBOXYLIC ACID AND DERIVATIVES THEREOF | SEA PHARMACEUTICALS LLC (US) | 2023-07-06 | — | — | WO | disclosed |