Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042971 | 0.89 | NAMPT (0.37) | — | |
| SCHEMBL20042913 | 0.84 | PREP (0.37) | KDM4ESMN1; SMN2MEN1KMT2AKEAP1 | |
| SCHEMBL31614760 | 0.79 | SMN1; SMN2 (0.36) | KDM4ESMN1; SMN2MEN1KMT2AHPGD | |
| SCHEMBL20042786 | 0.77 | LMNA (0.36) | KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL20042958 | 0.76 | TACR3 (0.42) | KCNH2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL20042865 | 0.76 | TACR3 (0.42) | KCNH2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL20042851 | 0.76 | P2RX7 (0.46) | KCNH2SMN1; SMN2KMT2AALDH1A1CYP2C9 | |
| SCHEMBL20042982 | 0.76 | P2RX7 (0.46) | KCNH2SMN1; SMN2KMT2AALDH1A1CYP2C9 | |
| SCHEMBL20042990 | 0.76 | CNR1 (0.37) | KDM4ESMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL20042742 | 0.76 | PROKR1 (0.35) | KCNH2KDM4ESMN1; SMN2MEN1KMT2A |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |