Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TNF | P01375 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22013565 | 0.83 | NPC1 (0.47) | NOS1NPC1TNFRAB9ANOD1 | |
| SCHEMBL23665769 | 0.80 | ENPP2 (0.46) | NOS1NPC1TNFRAB9ANOD1 | |
| SCHEMBL20533585 | 0.80 | HTR6 (0.46) | NOS1NPC1TNFRAB9ANOD1 | |
| SCHEMBL22002789 | 0.78 | CA2 (0.55) | NOS1NPC1TNFRAB9ANOD1 | |
| SCHEMBL21893020 | 0.75 | NOS1 (0.44) | NOS1NPC1TNFRAB9ANOD1 | |
| SCHEMBL14025594 | 0.73 | TAS2R14 (0.60) | ALDH1A1TSHRHTR2ACA2MEN1 | |
| SCHEMBL989636 | 0.72 | ALDH1A1 (0.67) | NOS1ALDH1A1TSHRHTR7HPGD | |
| SCHEMBL20533666 | 0.71 | KMT2A (0.50) | TSHRCASP3HPGDCA2MEN1 | |
| SCHEMBL23356399 | 0.70 | LMNA (0.59) | ALDH1A1TSHRHTR6CA2 | |
| SCHEMBL31755421 | 0.70 | LMNA (0.59) | ALDH1A1TSHRHTR6CA2 |
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 |