Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMP | P19971 | 1/20 | 0.42 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.41 |
| ▸ | FABP3 | P05413 | 1/20 | 0.41 |
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL31067050 | 0.89 | PTGES (0.43) | TYMPFABP3FABP4NOS3MAPK14 | |
| SCHEMBL4456487 | 0.79 | CYP1A2 (0.50) | GRIA1CACNG8FABP3FABP4TSHR | |
| Methane SCHEMBL27488133 | 0.79 | SMARCA2 (0.37) | FABP3FABP4MAPK14PTGS2CYP1A2 | |
| SCHEMBL8326328 | 0.76 | TYMP (0.40) | TYMPMAPK14PTGS2TSHRNPC1 | |
| SCHEMBL308199 | 0.76 | CYP2A6 (0.55) | TYMPGRIA1CACNG8FABP3FABP4 | |
| SCHEMBL1047283 | 0.75 | PBRM1 (0.42) | GRIA1CACNG8FABP3FABP4PTGS2 | |
| SCHEMBL14055104 | 0.75 | CYP3A4 (0.48) | GRIA1CACNG8TSHRCYP1A2CYP2A6 | |
| SCHEMBL30507348 | 0.75 | MGAM (0.46) | GRIA1CACNG8MAPK14TSHRCYP1A2 | |
| SCHEMBL2090138 | 0.75 | GRIA1 (0.46) | GRIA1CACNG8FABP3FABP4TSHR | |
| SCHEMBL28066782 | 0.75 | ESR1 (0.48) | GRIA1CACNG8TSHRPOLBHSD17B10 |
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-2964635-B1 | ANTIVIRAL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2018-05-02 | — | — | EP | disclosed |