Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | CFTR | P13569 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5565676 | 0.94 | MAPT (0.57) | CYP3A4TSHRPIK3CAMAPTGAA | |
| SCHEMBL11461051 | 0.86 | MAPT (0.69) | CYP3A4TSHRPIK3CAMAPTGAA | |
| SCHEMBL7637780 | 0.86 | CDC25B (0.57) | CYP3A4TSHRMAPTALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL27541932 | 0.85 | MAPT (0.67) | MAPTGAAALDH1A1HSD17B10KDM4E | |
| SCHEMBL29622715 | 0.84 | MMP2 (0.61) | CYP3A4TSHRPIK3CAMAPTGAA | |
| SCHEMBL836606 | 0.84 | CYP3A4 (0.54) | CYP3A4TSHRPIK3CAMAPTGAA | |
| SCHEMBL412192 | 0.84 | MMP2 (0.61) | CYP3A4TSHRPIK3CAMAPTGAA | |
| SCHEMBL529786 | 0.84 | TSHR (0.54) | CYP3A4TSHRPIK3CAMAPTGAA | |
| SCHEMBL16752009 | 0.84 | MAPK13 (0.49) | CYP3A4TSHRPIK3CAMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL10708599 | 0.83 | MMP2 (0.59) | CYP3A4TSHRPIK3CAMAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-1726218-A | Pyrrolopyrimidine derivatives | PFIZER PROD INC (US) | 2006-01-25 | — | — | CN | disclosed |