Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22002789 | 0.84 | CA2 (0.55) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL22013568 | 0.83 | NOS1 (0.43) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL25488460 | 0.83 | NPC1 (0.43) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL19496815 | 0.82 | HSD17B1 (0.53) | HTR7RORCHSD17B1HSD17B2 | |
| SCHEMBL533931 | 0.81 | ALDH1A1 (0.46) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL29411715 | 0.81 | ALDH1A1 (0.46) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL21893020 | 0.81 | NOS1 (0.44) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL7054313 | 0.79 | ALDH1A1 (0.47) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL8233359 | 0.79 | ALDH1A1 (0.47) | NPC1TNFRAB9ANOD1ALDH1A1 | |
| SCHEMBL14025594 | 0.78 | TAS2R14 (0.60) | ALDH1A1TSHRSLC6A4 |
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 |