Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 6/20 | 0.37 |
| ▸ | FNTA | P49354 | 1/20 | 0.37 |
| ▸ | FNTB | P49356 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | PRNP | P04156 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9759522 | 0.86 | PTGS1 (0.37) | PTGS1PTGS2BCHEFNTAFNTB | |
| SCHEMBL9759527 | 0.86 | PTGS1 (0.37) | PTGS1PTGS2BCHEFNTAFNTB | |
| SCHEMBL9759957 | 0.82 | PTGS1 (0.40) | PTGS1PTGS2NOX1BCHEFNTA | |
| SCHEMBL20345839 | 0.80 | PTGS1 (0.54) | PTGS1PTGS2NOX1BCHECYP2D6 | |
| SCHEMBL9331439 | 0.77 | LMNA (0.46) | PTGS1PTGS2BCHECYP2D6LMNA | |
| SCHEMBL9331442 | 0.77 | LMNA (0.46) | PTGS1PTGS2BCHECYP2D6LMNA | |
| SCHEMBL9791007 | 0.68 | MAOA (0.48) | PTGS1PTGS2NOX1BCHECYP2D6 | |
| SCHEMBL12386881 | 0.66 | PTGS1 (0.51) | PTGS1PTGS2BCHECYP2D6LMNA | |
| SCHEMBL9331947 | 0.66 | LMNA (0.41) | PTGS1PTGS2NOX1BCHECYP2D6 | |
| SCHEMBL29960525 | 0.66 | MAOA (0.34) | NOX1BCHEFNTAFNTBCYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5049669-A | Also diuretics | RHONE-POULENC SANTE (FR) | 1991-09-17 | — | — | US | disclosed |
| US-4985419-A | Analgesics, Diuretics | RHONE-POULENC SANTE (FR) | 1991-01-15 | — | — | US | disclosed |
| US-4912105-A | Derivatives of phenothiazine and the compositions which contain them | RHONE-POULENC SANTE (FR) | 1990-03-27 | — | — | US | disclosed |