Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP2 | P42575 | 2/20 | 0.59 |
| ▸ | CA12 | O43570 | 5/20 | 0.52 |
| ▸ | CA6 | P23280 | 5/20 | 0.52 |
| ▸ | CA7 | P43166 | 5/20 | 0.52 |
| ▸ | CA9 | Q16790 | 5/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.52 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.52 |
| ▸ | CA2 | P00918 | 4/20 | 0.52 |
| ▸ | CA4 | P22748 | 4/20 | 0.52 |
| ▸ | CA5A | P35218 | 4/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.52 |
| ▸ | F13A1 | P00488 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | THPO | P40225 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | RECQL | P46063 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7762477 | 0.93 | CA12 (0.52) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL10537471 | 0.93 | CA12 (0.58) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL1644428 | 0.88 | CA12 (0.50) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL13989322 | 0.86 | CA12 (0.56) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL3015969 | 0.84 | CA12 (0.48) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL9325021 | 0.84 | CA12 (0.52) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL11224669 | 0.83 | CA12 (0.48) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL12338141 | 0.82 | ESR1 (0.63) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL11227502 | 0.82 | CA12 (0.50) | CASP2CA12CA6CA7CA9 | |
| SCHEMBL2604431 | 0.82 | CA12 (0.46) | CASP2CA12CA6CA7CA9 |
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-0273342-B1 | 1,3-BIS-SUBSTITUTED-2-PROPANOL DERIVATIVES CONTAINING AMINO GROUPS, PROCESSES FOR THEIR PREPARATION AND THEIR USE | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-23 | — | — | EP | disclosed |