Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 6/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
| ▸ | CA4 | P22748 | 4/20 | 0.36 |
| ▸ | CA6 | P23280 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14563351 | 0.79 | PTGS1 (0.42) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL8137296 | 0.78 | THRB (0.35) | THRBKMT2ASLC6A3 | |
| SCHEMBL28719852 | 0.75 | PTGS1 (0.40) | PTGS1PTGS2CA1CA2CA4 | |
| SCHEMBL497183 | 0.74 | HTT (0.39) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL9731960 | 0.74 | HTT (0.39) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL14563269 | 0.74 | THRB (0.43) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL10743083 | 0.73 | HTT (0.41) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL13902511 | 0.73 | THRB (0.42) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL24866839 | 0.71 | THRB (0.41) | PTGS1PTGS2THRBCA1CA2 | |
| SCHEMBL8550292 | 0.71 | CA1 (0.35) | PTGS1PTGS2CA1CA2CA4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0821674-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-02-04 | — | — | EP | disclosed |