Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 1/20 | 0.53 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5032606 | 0.77 | MAPT (0.55) | CYP1A2CYP2C19CYP2C9KMT2ASMN1; SMN2 | |
| SCHEMBL5032613 | 0.77 | MAPT (0.55) | CYP1A2CYP2C19CYP2C9KMT2ASMN1; SMN2 | |
| SCHEMBL15682833 | 0.75 | IMPDH2 (0.68) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL15338460 | 0.75 | IMPDH2 (0.67) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL1184403 | 0.74 | KMT2A (0.57) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7760777 | 0.74 | CYP1A2 (0.65) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL21756771 | 0.73 | KIF11 (0.49) | KMT2ASMN1; SMN2RAB9AKDM4ENPC1 | |
| SCHEMBL20938764 | 0.73 | IMPDH2 (0.53) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL4100667 | 0.73 | SMN1; SMN2 (0.56) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7166437 | 0.73 | KMT2A (0.60) | IMPDH2IMPDH1CYP1A2CYP2C19CYP2C9 |
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-2020041556-A1 | N-SUBSTITUTED-1H-1,2,4-TRIAZOLE-3-CARBOXAMIDES, ANALOGUES THEREOF, AND METHODS OF TREATMENT USING SAME | THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) | 2020-02-27 | — | — | WO | disclosed |