Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 4/20 | 0.36 |
| ▸ | HTR2C | P28335 | 4/20 | 0.36 |
| ▸ | HTR2B | P41595 | 4/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL9744496 | 0.78 | PTGS2 (0.39) | PTGS2PTGS1HTR2AHTR2CHTR2B | |
| SCHEMBL9744491 | 0.78 | PTGS2 (0.39) | PTGS2PTGS1HTR2AHTR2CHTR2B | |
| SCHEMBL9745003 | 0.74 | SIGMAR1 (0.37) | PTGS2PTGS1HTR2AHTR2CHTR2B | |
| SCHEMBL9577638 | 0.72 | KMT2A (0.42) | MTNR1AMTNR1BPOLBPKMSMN1; SMN2 | |
| SCHEMBL6859836 | 0.66 | HTR2A (0.42) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL3054003 | 0.64 | SIGMAR1 (0.57) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL29447988 | 0.64 | SIGMAR1 (0.57) | HTR2AHTR2CHTR2BSIGMAR1DRD2 | |
| SCHEMBL9764142 | 0.61 | PTGS2 (0.51) | PTGS2PTGS1HTR2ANPC1RAB9A | |
| SCHEMBL8525738 | 0.61 | HPGD (0.44) | PTGS2PTGS1HTR2AHTR2CHTR2B | |
| SCHEMBL8525737 | 0.61 | HPGD (0.44) | PTGS2PTGS1HTR2AHTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-5114964-A | Aryl-substituted benzocycloalkyl-derived anti-atherosclerotic agents | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1992-05-19 | — | — | US | disclosed |