Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.34 |
| ▸ | PRKCA | P17252 | 2/20 | 0.33 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | GALR3 | O60755 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5580290 | 1.00 | TSHR (0.36) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL5580073 | 1.00 | TSHR (0.36) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL19493385 | 0.83 | PRKCA (0.40) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL7723645 | 0.82 | AR (0.35) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL7719955 | 0.82 | AR (0.35) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL7716828 | 0.82 | AR (0.35) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL13491728 | 0.80 | TDP1 (0.44) | TSHRSMN1; SMN2LMNAMEN1CYP1A2 | |
| SCHEMBL28797081 | 0.80 | MAPT (0.34) | PRKCAIMPDH2MAPTCTSLCTSB | |
| SCHEMBL28797083 | 0.80 | MAPT (0.34) | PRKCAIMPDH2MAPTCTSLCTSB | |
| SCHEMBL1584634 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1964561-A1 | Inhibitors of IMPDH enzyme | Vertex Pharmaceuticals Incorporated (US) | 2008-09-03 | — | — | EP | disclosed |