Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 3/20 | 0.59 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Decane SCHEMBL28276194 | 0.98 | NAAA (0.56) | NAAAEPHX1EPHX2BCHEALDH1A1 | |
| Hexane SCHEMBL27547172 | 0.98 | NAAA (0.56) | NAAAEPHX1EPHX2BCHE | |
| Nonane SCHEMBL28229702 | 0.98 | NAAA (0.56) | NAAAEPHX1EPHX2BCHEALDH1A1 | |
| Hexadecane SCHEMBL27279722 | 0.98 | NAAA (0.56) | NAAAEPHX1EPHX2BCHEALDH1A1 | |
| Heptadecanoic Acid SCHEMBL28221001 | 0.91 | GPR84 (0.61) | NAAAALDH1A1TSHRSLC22A6SLC22A8 | |
| Dodecylamine SCHEMBL7596000 | 0.91 | NAAA (0.51) | NAAAEPHX1EPHX2BCHEALDH1A1 | |
| Decanoic Acid SCHEMBL27304522 | 0.91 | GPR84 (0.61) | NAAAALDH1A1TSHRSLC22A6SLC22A8 | |
| Stearic Acid SCHEMBL9077132 | 0.91 | GPR84 (0.61) | NAAAALDH1A1TSHRSLC22A6SLC22A8 | |
| SCHEMBL28774324 | 0.89 | NAAA (0.50) | NAAAEPHX1EPHX2BCHE | |
| Hexadecane SCHEMBL28525033 | 0.89 | PLG (0.48) | NAAAALDH1A1TSHRSLC22A6SLC22A8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105764902-B | Spiro-compound as tryptophan hydroxylase inhibitor | 卡罗斯制药公司 | 2019-02-15 | — | — | CN | claimed |
| CN-105764902-A | Spirocyclic compounds as tryptophan hydroxylase inhibitors | 卡罗斯制药公司 | 2016-07-13 | — | — | CN | claimed |