Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 8/20 | 0.36 |
| ▸ | CA2 | P00918 | 8/20 | 0.36 |
| ▸ | CA4 | P22748 | 4/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 5/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8581434 | 0.96 | ITGB3 (0.37) | ITGB3ITGA2BPPARGPPARAACACB | |
| SCHEMBL8340697 | 0.88 | ACACB (0.38) | ITGB3ITGA2BACACB | |
| SCHEMBL8874523 | 0.88 | ITGA4 (0.40) | CA1CA2CA4 | |
| SCHEMBL21852438 | 0.84 | MAOB (0.38) | CA1CA2PPARAACACBMAOB | |
| SCHEMBL8337075 | 0.84 | NR1D1 (0.38) | ACACB | |
| SCHEMBL7666444 | 0.83 | ATM (0.40) | CA1 | |
| SCHEMBL8340745 | 0.82 | KMT2A (0.43) | MAOBLTA4H | |
| SCHEMBL8579424 | 0.81 | ALDH1A1 (0.43) | PPARGPPARAACACBMAOB | |
| SCHEMBL8668171 | 0.81 | ACACB (0.37) | ITGB3ITGA2BPPARGPPARAACACB | |
| SCHEMBL8338898 | 0.80 | ALDH1A1 (0.43) | PPARGPPARAACACBMAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-5679852-A | Process for the production of DTPA-monoamides of the central carboxylic acid and their use as pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-10-21 | — | — | US | disclosed |
| US-5676923-A | SOLUBLE, STABLE, ORGAN-SPECIFIC NUCLEAR MAGNETIC RESONANCE CONTRAST AGENT | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-10-14 | — | — | US | disclosed |
| US-5676926-A | Process for the production of DTPA-tetraesters of terminal carboxylic acids | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-10-14 | — | — | US | disclosed |
| US-5514810-A | Process for the production of DTPA-tetraesters of terminal carboxylic acids | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-05-07 | — | — | US | disclosed |