Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | CA5A | P35218 | 4/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28201094 | 0.78 | KMT2A (0.48) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL4632377 | 0.76 | KMT2A (0.50) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL4377617 | 0.76 | KMT2A (0.50) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL4370676 | 0.76 | KMT2A (0.50) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL22838370 | 0.75 | ALDH1A1 (0.67) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL27566680 | 0.74 | ALDH1A1 (0.60) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| Ethyl Acetate SCHEMBL27913557 | 0.74 | KMT2A (0.55) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL16503505 | 0.74 | ALDH1A1 (0.74) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL26451956 | 0.74 | ALDH1A1 (0.63) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 | |
| SCHEMBL24146497 | 0.74 | ALDH1A1 (0.66) | ALDH1A1KMT2AMEN1CYP2C19CYP1A2 |
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-5929120-A | Guainidino, formamidino, amino and related compounds for inhibiting osteoclast-mediated bone resorption | MERCK & CO., INC. (US) | 1999-07-27 | — | — | US | disclosed |