Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 14/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | GRN | P28799 | 2/20 | 0.48 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27811138 | 0.84 | PTGDR2 (0.61) | PTGDR2SMN1; SMN2TDP1GRNSORT1 | |
| SCHEMBL27831439 | 0.77 | PTGDR2 (0.45) | PTGDR2POLBLMNAKMT2A | |
| SCHEMBL1757544 | 0.77 | PTGDR2 (1.00) | PTGDR2 | |
| SCHEMBL3434175 | 0.74 | GRN (0.57) | PTGDR2SMN1; SMN2TDP1GRNSORT1 | |
| SCHEMBL1757923 | 0.74 | PTGDR2 (0.82) | PTGDR2KMT2A | |
| SCHEMBL27831444 | 0.72 | PTGDR2 (0.46) | PTGDR2LMNAKMT2A | |
| SCHEMBL27687138 | 0.71 | SMN1; SMN2 (0.69) | SMN1; SMN2TDP1GRNSORT1POLB | |
| SCHEMBL27811239 | 0.70 | CA12 (0.72) | SMN1; SMN2TDP1GRNSORT1POLB | |
| SCHEMBL1757148 | 0.70 | PTGDR2 (0.84) | PTGDR2 | |
| SCHEMBL5178107 | 0.69 | GRN (0.67) | SMN1; SMN2TDP1GRNSORT1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102093341-B | Indole ring substituted pyrazole carboxylic acid endothelin receptor antagonist as well as preparation method and application thereof | TIANJIN INST PHARM RESEARCH | 2013-07-24 | — | — | CN | disclosed |
| CN-102093341-A | Indole ring substituted pyrazole carboxylic acid endothelin receptor antagonist as well as preparation method and application thereof | TIANJIN INST PHARM RESEARCH | 2011-06-15 | — | — | CN | disclosed |