Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 8/20 | 0.39 |
| ▸ | CA2 | P00918 | 8/20 | 0.39 |
| ▸ | CA9 | Q16790 | 7/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | FDPS | P14324 | 3/20 | 0.39 |
| ▸ | CA3 | P07451 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20376269 | 0.98 | TP53 (0.43) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL11402838 | 0.95 | TP53 (0.45) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL19661537 | 0.95 | TP53 (0.45) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL19135624 | 0.95 | TP53 (0.45) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL20204682 | 0.93 | TP53 (0.46) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL18563091 | 0.91 | CA2 (0.35) | TP53CA1CA2CA9CA12 | |
| SCHEMBL11649573 | 0.86 | TP53 (0.42) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL11395612 | 0.86 | TP53 (0.42) | TP53CA1CA2CA9GPR84 | |
| SCHEMBL23865769 | 0.85 | CA1 (0.41) | TP53CA1CA2CA12CA7 | |
| SCHEMBL8813648 | 0.84 | TP53 (0.43) | TP53CA1CA2CA9GPR84 |
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-3068391-B1 | ARYL LINKED IMIDAZOLE AND TRIAZOLE DERIVATIVES AND METHODS OF USE THEREOF FOR IMPROVING THE PHARMACOKINETICS OF A DRUG | MERCK SHARP & DOHME (US) | 2018-05-23 | — | — | EP | disclosed |