Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9461045 | 0.90 | ALDH1A1 (0.48) | CYP1A2KDM4EALDH1A1HSP90AB1LMNA | |
| SCHEMBL15317599 | 0.90 | ALDH1A1 (0.43) | CYP1A2KDM4EALDH1A1HSP90AB1LMNA | |
| SCHEMBL10828626 | 0.88 | ALDH1A1 (0.42) | CYP1A2KDM4EALDH1A1HSP90AB1LMNA | |
| SCHEMBL5092329 | 0.84 | CYP1A2 (0.48) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL8687010 | 0.84 | KDM4E (0.49) | CYP1A2KDM4EALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL10828486 | 0.83 | ALDH1A1 (0.38) | CYP1A2KDM4EALDH1A1HSP90AB1SMN1; SMN2 | |
| SCHEMBL7013448 | 0.82 | ALDH1A1 (0.50) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL1720666 | 0.82 | CYP1A2 (0.52) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL8687107 | 0.82 | TSHR (0.45) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL12479800 | 0.81 | CYP1A2 (0.47) | CYP1A2KDM4EALDH1A1LMNASMN1; SMN2 |
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-5821368-A | Method for preparing pyrimidin-2-ylacetic acid esters | LONZA AG (CH) | 1998-10-13 | — | — | US | disclosed |