Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2995137 | 0.86 | MEN1 (0.31) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL14319152 | 0.86 | MEN1 (0.31) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL21216739 | 0.76 | — | — | |
| SCHEMBL4965702 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL24584722 | 0.74 | MEN1 (0.44) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL24583913 | 0.74 | MEN1 (0.44) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL14826678 | 0.74 | MEN1 (0.30) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL24583886 | 0.74 | MEN1 (0.44) | MEN1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL20792186 | 0.74 | — | — | |
| SCHEMBL18537440 | 0.74 | ADRA2A (0.39) | — |
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-7214828-B2 | Durable coating compositions containing novel aspartic amine compounds | E. I. DUPONT DE NEMOURS AND COMPANY (US) | 2007-05-08 | — | — | US | disclosed |