Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 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 | |
|---|---|---|---|---|
| SCHEMBL11832526 | 0.98 | GPR84 (0.39) | PTGS2ALDH1A1AHRGPR84HTR2A | |
| SCHEMBL10652423 | 0.89 | PTGS2 (0.51) | PTGS2 | |
| SCHEMBL11262297 | 0.87 | PTGS2 (0.39) | PTGS2GPR84HTR2AIDO1 | |
| SCHEMBL11258879 | 0.83 | HSD17B10 (0.37) | MMP1MMP9MMP13ADAM17 | |
| SCHEMBL9079558 | 0.81 | GPR84 (0.41) | PTGS2ALDH1A1AHRGPR84HTR2A | |
| SCHEMBL20802184 | 0.81 | GPR84 (0.41) | PTGS2ALDH1A1AHRGPR84HTR2A | |
| SCHEMBL15995905 | 0.77 | CHRNA7 (0.45) | ALDH1A1SLC2A1 | |
| Methoxymethane SCHEMBL11832518 | 0.77 | ADRB2 (0.49) | PTGS2 | |
| SCHEMBL18948482 | 0.76 | GPR84 (0.40) | PTGS2ALDH1A1AHRGPR84HTR2A | |
| SCHEMBL7470616 | 0.76 | GPR84 (0.40) | PTGS2ALDH1A1AHRGPR84HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4180669-A | ANTISECRETORY AGENTS | ABBOTT LABORATORIES (US) | 1979-12-25 | — | — | US | disclosed |
| US-3951970-A | ANTIDEPRESSANT, HYPOTENSIVE | SHARPS ASSOCIATES (US) | 1976-04-20 | — | — | US | disclosed |