Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.58 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.58 |
| ▸ | CPA3 | P15088 | 1/20 | 0.54 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.52 |
| ▸ | KEAP1 | Q14145 | 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 | |
|---|---|---|---|---|
| SCHEMBL3223107 | 0.93 | HDAC3 (0.61) | MAPTRXFP1HDAC3MAPK1ADRA1A | |
| SCHEMBL1035000 | 0.90 | MAPT (0.69) | MAPTRXFP1HDAC3MAPK1ADRA1A | |
| SCHEMBL1122049 | 0.90 | MAPT (0.69) | MAPTRXFP1HDAC3MAPK1ADRA1A | |
| SCHEMBL1862995 | 0.86 | GRIK1 (0.61) | MAPTRXFP1HDAC3MAPK1ADRA1A | |
| SCHEMBL7350860 | 0.86 | CPA3 (0.71) | MAPTRXFP1HDAC3MAPK1ADRA1A | |
| SCHEMBL31303730 | 0.85 | CPA3 (0.75) | MAPTRXFP1HDAC3HDAC1HDAC8 | |
| SCHEMBL28600681 | 0.85 | CPA3 (0.75) | MAPTRXFP1HDAC3HDAC1HDAC8 | |
| SCHEMBL11143841 | 0.85 | CPA3 (0.75) | MAPTRXFP1HDAC3HDAC1HDAC8 | |
| SCHEMBL28430963 | 0.85 | CPA3 (0.75) | MAPTRXFP1HDAC3HDAC1HDAC8 | |
| Phenylbutanoic Acid SCHEMBL5010097 | 0.85 | HDAC3 (0.60) | MAPTRXFP1HDAC3MAPK1ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0794938-A1 | NOVEL SUBSTITUTED DTPA DERIVATIVES, THEIR METAL COMPLEXES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPLEXES AND THEIR USE IN DIAGNOSIS AND THERAPY | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-09-17 | — | — | EP | claimed |
| WO-1996016928-A1 | NOVEL SUBSTITUTED DTPA DERIVATIVES, THEIR METAL COMPLEXES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPLEXES AND THEIR USE IN DIAGNOSIS AND THERAPY | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-06-06 | — | — | WO | claimed |