Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 7/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | SCD | O00767 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL12481110 | 0.91 | OPRD1 (0.65) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL30538347 | 0.91 | OPRD1 (0.65) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL20109488 | 0.88 | OPRD1 (0.46) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL11244376 | 0.80 | OPRD1 (0.47) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL15717425 | 0.80 | OPRD1 (0.47) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL1115144 | 0.78 | OPRD1 (0.46) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL12162414 | 0.78 | OPRD1 (0.46) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL5312276 | 0.73 | KMT2A (0.62) | OPRD1SCDKMT2AHDAC3HDAC4 | |
| SCHEMBL16503896 | 0.73 | KMT2A (0.46) | OPRD1KCNH2CYP2D6SCDKMT2A | |
| SCHEMBL12481437 | 0.73 | OPRD1 (0.62) | OPRD1KCNH2CYP2D6KMT2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| CN-111094293-A | Substituted benzoxazole and benzofuran compounds as PDE7 inhibitors | 达特神经科学有限公司 | 2020-05-01 | — | — | CN | claimed |
| CN-111094293-A | Substituted benzoxazole and benzofuran compounds as PDE7 inhibitors | 达特神经科学有限公司 | 2020-05-01 | — | — | CN | disclosed |