Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17597642 | 0.83 | PDE4D (0.38) | SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL17595071 | 0.75 | TBXAS1 (0.44) | ALDH1A1LMNA | |
| SCHEMBL2169327 | 0.74 | ALDH1A1 (0.41) | ALDH1A1RAB9ACYP3A4TSHRCYP2C19 | |
| SCHEMBL17596793 | 0.73 | GAA (0.34) | GAAKMT2AALDH1A1KDM4ELMNA | |
| SCHEMBL6227388 | 0.72 | ALDH1A1 (0.53) | ALDH1A1RAB9ACYP3A4TSHRCYP2C19 | |
| SCHEMBL17592613 | 0.70 | SYK (0.36) | SMN1; SMN2ALDH1A1CYP3A4LMNASLC6A2 | |
| SCHEMBL6227310 | 0.70 | CYP2C19 (0.55) | ALDH1A1RAB9ACYP3A4TSHRCYP2C19 | |
| SCHEMBL17099581 | 0.69 | FGFR1 (0.40) | MEN1GAAKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL5015440 | 0.68 | CYP2C19 (0.41) | SMN1; SMN2ALDH1A1RAB9ACYP2C19LMNA | |
| SCHEMBL17099589 | 0.67 | BLM (0.33) | SMN1; SMN2RAB9ACYP3A4TSHR |
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-2015143376-A1 | NOVEL COMPOUNDS FOR THE TREATMENT OF CYSTIC FIBROSIS | NIVALIS THERAPEUTICS, INC. (US) | 2015-09-24 | — | — | WO | disclosed |