Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 18/20 | 0.82 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.75 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.72 |
| ▸ | MEN1 | O00255 | 1/20 | 0.72 |
| ▸ | PTGES | O14684 | 1/20 | 0.72 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.72 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.72 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.72 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.72 |
| ▸ | LMNA | P02545 | 1/20 | 0.72 |
| ▸ | ALB | P02768 | 1/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.72 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.72 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.72 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.72 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.72 |
| ▸ | AR | P10275 | 1/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.72 |
| ▸ | MAPT | P10636 | 1/20 | 0.72 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.72 |
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 | |
|---|---|---|---|---|
| SCHEMBL11849998 | 1.00 | PTGS2 (0.82) | PTGS2PTGS1KDM4EMEN1PTGES | |
| Sermetacin SCHEMBL42767 | 0.92 | PTGS2 (0.81) | PTGS2PTGS1 | |
| Sermetacin SCHEMBL11850010 | 0.92 | PTGS2 (0.81) | PTGS2PTGS1 | |
| Sermetacin SCHEMBL11844892 | 0.92 | PTGS2 (0.81) | PTGS2PTGS1 | |
| SCHEMBL5112013 | 0.88 | PTGS2 (0.84) | PTGS2PTGS1 | |
| SCHEMBL8360236 | 0.87 | PTGS2 (0.76) | PTGS2PTGS1 | |
| SCHEMBL11836498 | 0.86 | PTGS2 (0.76) | PTGS2PTGS1 | |
| SCHEMBL11848583 | 0.86 | PTGS2 (0.79) | PTGS2PTGS1MAPTKMT2ANPSR1 | |
| SCHEMBL11845946 | 0.86 | PTGS2 (0.76) | PTGS2PTGS1 | |
| SCHEMBL11839861 | 0.86 | PTGS2 (0.79) | PTGS2PTGS1MAPTKMT2ANPSR1 |
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-3962471-A | Indolylacetylamino acid derivatives, process for their preparation, and pharmaceutical compositions | SCHERING AKTIENGESELLSCHAFT (DT) | 1976-06-08 | — | — | US | claimed |
| US-3962471-A | Indolylacetylamino acid derivatives, process for their preparation, and pharmaceutical compositions | SCHERING AKTIENGESELLSCHAFT (DT) | 1976-06-08 | — | — | US | disclosed |