Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19122294 | 1.00 | MEN1 (0.50) | MEN1MAPTKMT2ACYP2C9ESR1 | |
| SCHEMBL15745448 | 0.79 | ESR1 (0.42) | CYP2C9ESR1LMNASLC6A4HTR2A | |
| SCHEMBL12786251 | 0.76 | MEN1 (0.50) | MEN1MAPTKMT2ACYP2C9CRHBP | |
| SCHEMBL10687333 | 0.76 | MEN1 (0.50) | MEN1MAPTKMT2ACYP2C9CRHBP | |
| SCHEMBL9057813 | 0.76 | ESR1 (0.43) | MEN1MAPTKMT2ACYP2C9ESR1 | |
| SCHEMBL9235326 | 0.76 | CYP2D6 (0.41) | CYP2C9ESR1LMNASLC6A4HTR2A | |
| SCHEMBL16541507 | 0.75 | ESR1 (0.52) | CYP2C9ESR1LMNASLC6A4HTR2A | |
| SCHEMBL6203988 | 0.75 | ESR1 (0.52) | CYP2C9ESR1SLC6A4KCNH2TSHR | |
| SCHEMBL4244459 | 0.75 | ESR1 (0.52) | CYP2C9ESR1SLC6A4KCNH2TSHR | |
| SCHEMBL6220718 | 0.75 | ESR1 (0.52) | ESR1SLC6A4TSHRACHEADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7935728-B1 | Cyclic palladium compounds having coordinated thereto bis (diphenylphosphine) ferrocene ligands which inhibit the activity of proteins and enzymes and treatment of diseases and disorders associated therewith | FUNDACAO DE AMPARO A PESQUISA DO ESTADO DE SAO PAULO (BR) | 2011-05-03 | — | — | US | disclosed |
| US-7432403-B2 | Cyclic palladium compounds having coordinated thereto bis (diphenylphosphine) ferrocene ligands which inhibit the activity of proteins and enzymes and treatment of diseases and disorders associated therewith | Fundação De Amparo À Pesquisa Do Estado de São Paulo (BR) | 2008-10-07 | — | — | US | disclosed |