Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 10/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9535623 | 0.77 | PTGS2 (0.46) | CYP1A2LMNAF2RL3ALDH1A1CYP3A4 | |
| SCHEMBL9537300 | 0.75 | HSD11B1 (0.43) | HSD11B1TRPA1TRPM8TRPV1MAPK1 | |
| SCHEMBL14881386 | 0.69 | MAPK1 (0.45) | HSD11B1CYP1A2TRPA1TRPM8TRPV1 | |
| SCHEMBL3923233 | 0.68 | CRHR1 (0.37) | CYP1A2LMNACRHR1 | |
| SCHEMBL805589 | 0.66 | HSD11B1 (0.51) | HSD11B1CYP1A2TRPA1TRPM8TRPV1 | |
| SCHEMBL16265177 | 0.65 | DYRK1A (0.50) | HSD11B1CYP1A2F2RL3CYP3A4CYP2C19 | |
| SCHEMBL197671 | 0.65 | HSD11B1 (0.56) | HSD11B1CYP1A2TRPA1TRPM8TRPV1 | |
| SCHEMBL12962511 | 0.64 | PDE10A (0.45) | LMNAKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL16179896 | 0.64 | KMO (0.51) | HSD11B1F2RL3ALDH1A1 | |
| SCHEMBL9830541 | 0.64 | HSD11B1 (0.58) | HSD11B1CYP1A2TRPA1MAPK1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0353902-B1 | SUBSTITUTED PHENYLTRIAZOLOPYRIMIDINE HERBICIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-05-05 | — | — | EP | disclosed |
| US-5127936-A | Substituted phenyltriazolopyrimidine herbicides | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-07-07 | — | — | US | disclosed |
| EP-0353902-A1 | Substituted phenyltriazolopyrimidine herbicides | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-02-07 | — | — | EP | disclosed |