Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.62 |
| ▸ | CA12 | O43570 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.60 |
| ▸ | CA9 | Q16790 | 1/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.57 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11167209 | 0.84 | CASP3 (0.67) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL326305 | 0.84 | CASP3 (0.85) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL30472950 | 0.84 | CASP3 (0.85) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL9053599 | 0.82 | CASP3 (0.65) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL29820192 | 0.82 | CASP3 (0.65) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL8737445 | 0.82 | CASP3 (0.65) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL18668950 | 0.82 | CES2 (0.67) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL540079 | 0.81 | CHRM5 (0.68) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL13448352 | 0.81 | CA12 (0.65) | CASP3CA12CA1CA2CA9 | |
| SCHEMBL540514 | 0.81 | CASP3 (0.62) | CASP3CA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4008222-A | POLYESTERS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-02-15 | — | — | US | disclosed |