Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | RECQL | P46063 | 2/20 | 0.53 |
| ▸ | MMP8 | P22894 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6929834 | 0.81 | POLB (0.47) | ALDH1A1SMN1; SMN2HIF1AFDPSLMNA | |
| SCHEMBL28168069 | 0.80 | ALDH1A1 (0.67) | ALDH1A1RECQLMMP8SMN1; SMN2HIF1A | |
| SCHEMBL3425341 | 0.79 | CA12 (0.49) | ALDH1A1RECQLCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL22059597 | 0.79 | CA12 (0.49) | ALDH1A1RECQLCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2329888 | 0.79 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8SMN1; SMN2HIF1A | |
| SCHEMBL8410894 | 0.79 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8SMN1; SMN2HIF1A | |
| SCHEMBL2331138 | 0.79 | ALDH1A1 (0.53) | ALDH1A1RECQLMMP8SMN1; SMN2HIF1A | |
| SCHEMBL11119117 | 0.78 | HDAC2 (0.54) | ALDH1A1RECQLSMN1; SMN2LMNAKMT2A | |
| SCHEMBL6514301 | 0.78 | ALDH1A1 (0.65) | ALDH1A1RECQLMMP8SMN1; SMN2HIF1A | |
| Water SCHEMBL27509394 | 0.78 | CTSS (0.48) | ALDH1A1RECQLCYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998027051-A9 | CATALYTIC ASYMMETRIC AMIDOHYDROXYLATION OF OLEFINS WITH N-HALO CARBOXAMIDES | — | 1998-11-12 | — | — | WO | disclosed |
| WO-1998027051-A2 | CATALYTIC ASYMMETRIC AMIDOHYDROXYLATION OF OLEFINS WITH N-HALO CARBOXAMIDES | THE SCRIPPS RESEARCH INSTITUTE (US) | 1998-06-25 | — | — | WO | disclosed |