Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 15/20 | 0.80 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.79 |
| ▸ | TSHR | P16473 | 1/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL1581468 | 0.86 | PDE10A (1.00) | DHODHPDE10ATSHRKMT2ALMNA | |
| Hydrochloric Acid SCHEMBL27511204 | 0.84 | PDE10A (0.97) | DHODHPDE10ATSHRKMT2ALMNA | |
| SCHEMBL17593892 | 0.84 | DHODH (0.68) | DHODHPDE10ATSHR | |
| SCHEMBL13529075 | 0.81 | DHODH (0.76) | DHODHPDE10A | |
| SCHEMBL5205114 | 0.78 | PDE10A (0.68) | DHODHPDE10ATSHR | |
| SCHEMBL14492079 | 0.77 | PDE10A (0.68) | DHODHPDE10ATSHRLMNAPOLB | |
| SCHEMBL9052974 | 0.77 | DHODH (0.68) | DHODHPDE10ATSHR | |
| SCHEMBL3234894 | 0.76 | KDM4E (0.68) | DHODHPDE10ATSHRKMT2ALMNA | |
| SCHEMBL2372674 | 0.75 | PDE10A (0.73) | DHODHPDE10ATSHRKMT2ALMNA | |
| SCHEMBL4879923 | 0.75 | PDE10A (0.72) | DHODHPDE10ATSHRKMT2ALMNA |
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-5032597-A | Antitumor | DU PONT MERCK PHARMACEUTICAL (US) | 1991-07-16 | — | — | US | disclosed |
| EP-0133244-B1 | PHENYLQUINOLINECARBOXYLIC ACIDS AND DERIVATIVES AS ANTITUMOR AGENTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-12-05 | — | — | EP | disclosed |
| US-4680299-A | ANTITUMOR AGENTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-07-14 | — | — | US | disclosed |
| EP-0133244-A2 | Phenylquinolinecarboxylic acids and derivatives as antitumor agents | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-02-20 | — | — | EP | disclosed |