Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KLK7 | P49862 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6648123 | 0.78 | KDM4E (0.52) | KDM4EALDH1A1ACHECREBBPBRD4 | |
| SCHEMBL9704675 | 0.76 | CES1 (0.39) | KDM4EALDH1A1HPGDCREBBPBRD4 | |
| SCHEMBL22868112 | 0.72 | ACHE (0.46) | ALDH1A1ACHECREBBPBRD4KMT2A | |
| SCHEMBL20288981 | 0.71 | PBRM1 (0.51) | ALDH1A1CREBBPBRD4KMT2A | |
| SCHEMBL11724231 | 0.71 | ACHE (0.47) | ALDH1A1ACHECREBBPBRD4 | |
| SCHEMBL9704586 | 0.71 | CREBBP (0.43) | CREBBPBRD4 | |
| SCHEMBL3081827 | 0.70 | KDM4E (0.59) | KDM4EALDH1A1HPGDKLK7ACHE | |
| SCHEMBL3069771 | 0.70 | KDM4E (0.59) | KDM4EALDH1A1HPGDKLK7ACHE | |
| SCHEMBL3079250 | 0.70 | KDM4E (0.59) | KDM4EALDH1A1HPGDKLK7ACHE | |
| SCHEMBL222096 | 0.70 | PBRM1 (0.46) | CREBBPBRD4KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4018758-A | ANALGESICS | PFIZER INC. (US) | 1977-04-19 | — | — | US | disclosed |
| US-4013662-A | ANALGESICS, TRANQUILIZERS | PFIZER INC. (US) | 1977-03-22 | — | — | US | disclosed |
| US-3978064-A | ANALGESIC | PFIZER INC. (US) | 1976-08-31 | — | — | US | disclosed |
| US-3976650-A | Process for preparing optically active 6,7-dimethoxy-2-methyl-4-oxo-1,2,3,4-tetrahydro-1-quinoline carboxylic acid ester analgesics | PFIZER INC. (US) | 1976-08-24 | — | — | US | disclosed |