Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | PRKACG | P22612 | 1/20 | 0.33 |
| ▸ | PRKACB | P22694 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL22012064 | 0.76 | HTR2C (0.36) | P2RY1 | |
| SCHEMBL23972532 | 0.74 | HRH3 (0.50) | HRH3ALDH1A1TSHRLMNAGAA | |
| SCHEMBL13862131 | 0.73 | ALDH1A1 (0.45) | HRH3ALDH1A1TSHRTAAR1NOS1 | |
| SCHEMBL5913371 | 0.71 | HRH3 (0.39) | HRH3ALDH1A1TSHRLMNAGAA | |
| SCHEMBL20698712 | 0.71 | HRH3 (0.52) | HRH3ALDH1A1TSHRTAAR1NOS1 | |
| SCHEMBL8251603 | 0.71 | HRH3 (0.46) | HRH3ALDH1A1TSHRLMNAGAA | |
| SCHEMBL20048654 | 0.71 | NFE2L2 (0.34) | ALDH1A1TSHRLMNATAAR1ALOX15 | |
| SCHEMBL21419317 | 0.70 | ALDH1A1 (0.55) | HRH3ALDH1A1TSHRLMNAGAA | |
| SCHEMBL19674489 | 0.70 | ALDH1A1 (0.44) | ALDH1A1CA2 | |
| SCHEMBL24000519 | 0.70 | DAO (0.36) | ALDH1A1HTR7 |
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-2020102576-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |