Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5047408 | 0.82 | CTDSP1 (0.39) | CA1CA2CA9CA12CA4 | |
| SCHEMBL1819324 | 0.78 | TSHR (0.48) | CA1CA2CA9CA12CA4 | |
| SCHEMBL9548233 | 0.77 | ALDH1A1 (0.40) | CYP3A4ALDH1A1HSD17B10THRBHPGD | |
| SCHEMBL8472933 | 0.76 | CASP6 (0.43) | ALDH1A1HSD17B10KDM4EMEN1GAA | |
| SCHEMBL8953417 | 0.76 | ALDH1A1 (0.54) | CA1CA2CA9CA12CA4 | |
| SCHEMBL879153 | 0.73 | CA1 (0.68) | CA1CA2CA9CA12CA4 | |
| SCHEMBL31208448 | 0.73 | CA1 (0.68) | CA1CA2CA9CA12CA4 | |
| SCHEMBL20526669 | 0.73 | CA1 (0.61) | CA1CA2CA9CA12CA4 | |
| SCHEMBL13744645 | 0.72 | SNCA (0.43) | ALDH1A1TSHRHSD17B10HPGDMEN1 | |
| SCHEMBL13196224 | 0.72 | LMNA (0.38) | ALDH1A1TSHRHPGDRECQLGAA |
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-5231172-A | Water solubility | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-07-27 | — | — | US | disclosed |