Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27615779 | 0.86 | TDP1 (0.41) | TDP1HRH3SIGMAR1OPRD1CHRM2 | |
| Tert-Butyl Formate SCHEMBL28096891 | 0.82 | TDP1 (0.46) | TDP1HRH3SIGMAR1OPRD1CHRM2 | |
| SCHEMBL20569862 | 0.80 | HRH3 (0.37) | HRH3SIGMAR1OPRD1CHRM2CHRM1 | |
| SCHEMBL15471 | 0.80 | HRH3 (0.37) | HRH3SIGMAR1OPRD1CHRM2CHRM1 | |
| Tert-Butyl Formate SCHEMBL27634686 | 0.79 | GNAO1 (0.35) | TDP1SIGMAR1 | |
| SCHEMBL9813407 | 0.78 | HRH3 (0.36) | HRH3SIGMAR1OPRD1CHRM2CHRM1 | |
| Methyl Alcohol SCHEMBL27940927 | 0.78 | HRH3 (0.36) | HRH3SIGMAR1OPRD1CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL64916 | 0.78 | SMN1; SMN2 (0.38) | HRH3SIGMAR1OPRD1CHRM2CHRM1 | |
| Tert-Butyl Formate SCHEMBL28295231 | 0.78 | TDP1 (0.45) | TDP1OPRD1CHRM2CHRM1 | |
| Tert-Butyl Formate SCHEMBL27958701 | 0.78 | TDP1 (0.45) | TDP1SIGMAR1CHRM5CHRM3 |
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-101611014-B | Amidopyrazoles as FGFR inhibitors | ASTRAZENECA AB | 2012-05-30 | — | — | CN | disclosed |
| CN-101611014-A | Amidopyrazoles as FGFR inhibitors | ASTRAZENECA AB (SE) | 2009-12-23 | — | — | CN | disclosed |