Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.34 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18584448 | 0.79 | ALOX15 (0.51) | HSD11B1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL16539913 | 0.75 | ALDH1A1 (0.47) | HSD11B1ALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL29937434 | 0.72 | TRPA1 (0.43) | ALDH1A1MAPTKMT2AKDM4EGLA | |
| SCHEMBL6638222 | 0.72 | TRPA1 (0.43) | ALDH1A1MAPTKMT2AKDM4EGLA | |
| SCHEMBL1173555 | 0.71 | RAB9A (0.40) | ALDH1A1HPGDMAPTKMT2AADORA2A | |
| SCHEMBL1269550 | 0.70 | TUBB4A (0.49) | ALDH1A1HPGDMEN1KMT2AKDM4E | |
| SCHEMBL10015547 | 0.70 | NCEH1 (0.53) | HSD11B1ALDH1A1HPGDMAPTKDM4E | |
| SCHEMBL17836993 | 0.70 | HSD11B1 (0.46) | HSD11B1ALDH1A1HPGDMAPTCXCR2 | |
| SCHEMBL2015242 | 0.70 | EGLN1 (0.38) | HSD11B1ALDH1A1HPGDCXCR2MEN1 | |
| SCHEMBL2749092 | 0.70 | PDE4A (0.44) | HSD11B1ALDH1A1HPGDKMT2ACYP1A2 |
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 |