Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.48 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.48 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18838471 | 0.93 | KCNH2 (0.56) | HDAC1KCNH2HDAC4DRD4SIGMAR1 | |
| SCHEMBL18838506 | 0.83 | HTR2A (0.54) | HDAC1KCNH2HDAC4DRD4SIGMAR1 | |
| SCHEMBL18838396 | 0.82 | KCNH2 (0.48) | HDAC1KCNH2HDAC4DRD4SIGMAR1 | |
| SCHEMBL18860275 | 0.82 | DRD4 (0.54) | HDAC1KCNH2HDAC4DRD4SIGMAR1 | |
| SCHEMBL18838401 | 0.81 | KMT2A (0.54) | HDAC1KCNH2HDAC4DRD4SIGMAR1 | |
| SCHEMBL18838344 | 0.78 | CYP2D6 (0.46) | HDAC1HDAC4MCHR1CYP3A4CYP2D6 | |
| SCHEMBL18860223 | 0.77 | SCN9A (0.49) | HDAC1HDAC6KMT2AMEN1 | |
| SCHEMBL18838368 | 0.76 | CARM1 (0.46) | KCNH2MCHR1KMT2AMEN1 | |
| SCHEMBL10071958 | 0.76 | DRD4 (0.67) | DRD4 | |
| SCHEMBL19613995 | 0.76 | DRD4 (0.44) | DRD4SIGMAR1CYP2D6MAPK1DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0550025-A1 | Azaspiroheptanes and octanes and processes for their production | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 1993-07-07 | — | — | EP | claimed |
| EP-0550025-A1 | Azaspiroheptanes and octanes and processes for their production | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 1993-07-07 | — | — | EP | disclosed |