Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.37 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29292343 | 0.92 | GPR84 (0.59) | GPR84FFAR1NAAAZDHHC7 | |
| SCHEMBL6663357 | 0.82 | GPR84 (0.50) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL27724226 | 0.80 | GPR84 (0.48) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL309000 | 0.80 | GPR84 (0.48) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL7947554 | 0.80 | CA2 (0.61) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL438579 | 0.80 | GPR84 (0.48) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL149523 | 0.80 | CA2 (0.61) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL9028333 | 0.80 | CA2 (0.55) | CA2CA1TSHRCYP3A4ATM | |
| SCHEMBL4717732 | 0.78 | GPR84 (0.47) | GPR84FFAR1CA2CA1TSHR | |
| SCHEMBL8568010 | 0.78 | CA1 (0.47) | CA2CA1TSHRCYP3A4ATM |
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-105745327-A | High-yield route for producing compounds from renewable resources | 兹莫克姆有限公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-102702015-A | Preparation method of (2S, 3S)-3-amino-N-cyclopropyl-2-hydroxyhexanamide hydrochloride | Zhejiang xinhua pharmaceutical co ltd | 2012-10-03 | — | — | CN | disclosed |