Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.34 |
| ▸ | SCD | O00767 | 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 | |
|---|---|---|---|---|
| SCHEMBL5818912 | 0.91 | SMN1; SMN2 (0.41) | SMN1; SMN2SLC6A3MAPK1KDM4EHDAC3 | |
| SCHEMBL7775035 | 0.85 | TBXAS1 (0.42) | KDM4EKDM4CSCDTBXAS1 | |
| SCHEMBL7186166 | 0.84 | TBXAS1 (0.45) | SCDTBXAS1 | |
| SCHEMBL16116690 | 0.84 | TBXAS1 (0.45) | SCDTBXAS1 | |
| SCHEMBL907879 | 0.84 | KDM4E (0.44) | SLC6A3MAPK1KDM4EHDAC6KDM4C | |
| Citric Acid SCHEMBL4779312 | 0.76 | ALDH1A1 (0.40) | KDM4EPKMCYP1A2 | |
| SCHEMBL19051554 | 0.74 | SMN1; SMN2 (0.48) | SMN1; SMN2KDM4EHDAC3HDAC4HDAC1 | |
| Oxalic Acid SCHEMBL27277082 | 0.71 | KDM4E (0.39) | SMN1; SMN2SLC6A3MAPK1KDM4EKDM4C | |
| SCHEMBL21603086 | 0.68 | PKM (0.40) | SMN1; SMN2SLC6A3MAPK1KDM4EKDM4C | |
| Trifluoroacetic Acid SCHEMBL30101402 | 0.68 | KDM4E (0.74) | SMN1; SMN2KDM4EKDM4CALOX15 |
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-1732893-A2 | ALPHA ARYL OR HETEROARYL METHYL BETA PIPERIDINO PROPANAMIDE COMPOUNDS AS ORL1-RECEPTOR ANTAGONIST | Pfizer Japan, Inc. (JP) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005092858-A2 | ALPHA ARYL OR HETEROARYL METHYL BETA PIPERIDINO PROPANAMIDE COMPOUNDS AS ORL1-RECEPTOR ANTAGONIST | PFIZER JAPAN INC. (JP) | 2005-10-06 | — | — | WO | disclosed |