Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP12 | P39900 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8921592 | 1.00 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2MMP2MMP12LMNA | |
| SCHEMBL7590154 | 0.79 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2MMP2MMP12LMNA | |
| SCHEMBL7587316 | 0.79 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2MMP2MMP12LMNA | |
| SCHEMBL14501881 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHR | |
| SCHEMBL20581479 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2MMP12TSHR | |
| SCHEMBL20581478 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2MMP12TSHR | |
| SCHEMBL9815987 | 0.75 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2MMP2MMP12LMNA | |
| SCHEMBL9738613 | 0.75 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2MMP2MMP12LMNA | |
| SCHEMBL6508653 | 0.74 | TSHR (0.67) | ALDH1A1SMN1; SMN2MMP2MMP12LMNA | |
| SCHEMBL542708 | 0.74 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0759915-B1 | ASYMMETRIC SYNTHESIS OF CHIRAL SECONDARY ALCOHOLS | CELL THERAPEUTICS INC (US) | 2002-10-16 | — | — | EP | disclosed |
| US-5629423-A | Asymmetric synthesis of chiral secondary alcohols | CELL THERAPEUTICS, INC. (US) | 1997-05-13 | — | — | US | disclosed |
| EP-0759915-A1 | ASYMMETRIC SYNTHESIS OF CHIRAL SECONDARY ALCOHOLS | CELL THERAPEUTICS, INC. (US) | 1997-03-05 | — | — | EP | disclosed |
| WO-1995031450-A1 | ASYMMETRIC SYNTHESIS OF CHIRAL SECONDARY ALCOHOLS | CELL THERAPEUTICS, INC. (US) | 1995-11-23 | — | — | WO | disclosed |