Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4281831 | 1.00 | RAB9A (0.40) | RAB9ANPC1HPGDPPARGPPARD | |
| SCHEMBL4281811 | 0.88 | PTGES (0.42) | RAB9ANPC1HPGDKMT2ANPSR1 | |
| SCHEMBL4281738 | 0.86 | REN (0.37) | HPGDKMT2ALMNAKDM4ESMN1; SMN2 | |
| SCHEMBL4752327 | 0.86 | REN (0.37) | HPGDKMT2ALMNAKDM4ESMN1; SMN2 | |
| SCHEMBL13705341 | 0.86 | XIAP (0.44) | RAB9ANPC1PPARGPPARDPPARA | |
| SCHEMBL4752310 | 0.85 | PTGDR2 (0.39) | RAB9ANPC1HPGDPPARGPPARD | |
| SCHEMBL4286365 | 0.85 | PTGDR2 (0.39) | RAB9ANPC1HPGDPPARGPPARD | |
| Hydrochloric Acid SCHEMBL4290963 | 0.84 | KDM4E (0.43) | MEN1KMT2ANPSR1CYP2D6CYP2C19 | |
| SCHEMBL4292951 | 0.83 | KDM4E (0.43) | RAB9AHPGDPPARGMEN1KMT2A | |
| SCHEMBL4752088 | 0.82 | DRD3 (0.38) | RAB9AHPGDMEN1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008139941-A1 | SUBSTITUTED IMIDAZOLE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-11-20 | — | — | WO | disclosed |