Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.35 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.35 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.35 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.35 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.35 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.35 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.35 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.35 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.35 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18610316 | 0.91 | CYP11B1 (0.40) | CYP11B1CYP11B2PLK1TUBB4ATUBB | |
| SCHEMBL18584823 | 0.76 | CYP11B1 (0.46) | CYP11B1CYP11B2PLK1TUBB4ATUBB | |
| SCHEMBL18609940 | 0.74 | PLK1 (0.38) | PLK1ROCK2ROCK1CYP2C9PRKACA | |
| SCHEMBL18610025 | 0.72 | CASR (0.50) | ROCK2ROCK1CYP2C9PRKACAPRKG1 | |
| SCHEMBL18610132 | 0.70 | ROCK2 (0.39) | ROCK2ROCK1CYP2C9PRKACAPRKACG | |
| SCHEMBL18609246 | 0.69 | CASR (0.40) | PLK1ROCK2ROCK1CYP2C9PRKACA | |
| SCHEMBL18609855 | 0.69 | PFKFB3 (0.40) | KDM1AROCK2ROCK1ADORA2ACYP2C9 | |
| SCHEMBL18584869 | 0.69 | CASR (0.43) | CYP11B1CYP11B2PLK1ROCK2ROCK1 | |
| SCHEMBL18609660 | 0.68 | ROCK1 (0.41) | ROCK2ROCK1ADORA2AKDR | |
| SCHEMBL18609602 | 0.68 | ROCK1 (0.42) | ROCK2ROCK1CYP2C9PRKACAPRKACG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017037616-A1 | ARYLALKYLAMINE COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS | LUPIN LIMITED (IN) | 2017-03-09 | — | — | WO | disclosed |