Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL129629 | 0.84 | PKM (0.56) | PKMESR1CA2CA9CA12 | |
| SCHEMBL132005 | 0.77 | PKM (0.50) | PKMESR1CA2CA9CA12 | |
| SCHEMBL450584 | 0.72 | ESR1 (0.52) | PKMESR1CA2CA9CA12 | |
| SCHEMBL5500613 | 0.72 | PKM (0.50) | PKMESR1CA2CA9CA12 | |
| SCHEMBL10632559 | 0.72 | PKM (0.50) | PKMESR1CA2CA9CA12 | |
| SCHEMBL1704542 | 0.72 | PKM (0.50) | PKMESR1CA2CA9CA12 | |
| SCHEMBL11595292 | 0.72 | PKM (0.50) | PKMESR1CA2CA9CA12 | |
| SCHEMBL6562774 | 0.72 | ESR1 (0.43) | PKMESR1ALDH1A1NPSR1HSP90AA1 | |
| SCHEMBL5665562 | 0.71 | PKM (0.45) | PKMESR1CA2CA9CA12 | |
| SCHEMBL812682 | 0.70 | PKM (0.79) | PKMESR1CA2CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1682717-A1 | METHOD FOR THE REACTIVE COLOURING OF LEATHER | BASF Aktiengesellschaft (DE) | 2006-07-26 | — | — | EP | disclosed |
| WO-2005040490-A1 | METHOD FOR THE REACTIVE COLOURING OF LEATHER | BASF AKTIENGESELLSCHAFT (DE) | 2005-05-06 | — | — | WO | disclosed |