Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.53 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.53 |
| ▸ | REN | P00797 | 2/20 | 0.53 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1960890 | 0.85 | MAPT (0.62) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL9574969 | 0.84 | HDAC1 (0.49) | ALDH1A1NPSR1HDAC3MAPK1ADRA1A | |
| SCHEMBL13472619 | 0.84 | ALDH1A1 (0.54) | ALDH1A1NPSR1MAPK1RENLMNA | |
| SCHEMBL23791771 | 0.84 | ALDH1A1 (0.47) | ALDH1A1NPSR1HDAC3MAPK1ADRA1A | |
| SCHEMBL12443452 | 0.83 | RECQL (0.54) | ALDH1A1NPSR1HDAC3MAPK1ADRA1A | |
| SCHEMBL24325924 | 0.83 | ALDH1A1 (0.46) | ALDH1A1NPSR1HDAC3MAPK1ADRA1A | |
| SCHEMBL8966857 | 0.83 | TOP1 (0.47) | ALDH1A1NPSR1HDAC3MAPK1ADRA1A | |
| SCHEMBL825414 | 0.83 | LMNA (0.63) | ALDH1A1NPSR1HDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL19285762 | 0.82 | REN (0.75) | ALDH1A1NPSR1HDAC3HDAC1HDAC7 | |
| SCHEMBL5146175 | 0.82 | HDAC3 (0.62) | ALDH1A1NPSR1HDAC3MAPK1ADRA1A |
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-1104304-A1 | MULTIVALENT AVB3 AND METASTASIS-ASSOCIATED RECEPTOR LIGANDS | G.D. SEARLE & CO. (US) | 2001-06-06 | — | — | EP | disclosed |
| EP-1070085-A1 | DUAL A v?b 3? AND METASTASIS-ASSOCIATED RECEPTOR LIGANDS | G.D. SEARLE & CO. (US) | 2001-01-24 | — | — | EP | disclosed |
| WO-2000009143-A1 | MULTIVALENT AVB3 AND METASTASIS-ASSOCIATED RECEPTOR LIGANDS | G.D. SEARLE & CO. (US) | 2000-02-24 | — | — | WO | disclosed |
| WO-1999051638-A1 | DUAL Avb3 AND METASTASIS-ASSOCIATED RECEPTOR LIGANDS | G.D. SEARLE & CO. (US) | 1999-10-14 | — | — | WO | disclosed |