Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 11/20 | 0.52 |
| ▸ | PDE4A | P27815 | 3/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870468 | 0.93 | AKR1B1 (0.50) | AKR1B1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9203840 | 0.89 | AKR1B1 (0.56) | AKR1B1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9206507 | 0.78 | AKR1B1 (0.77) | AKR1B1 | |
| SCHEMBL10431004 | 0.77 | AKR1B1 (0.57) | AKR1B1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9872192 | 0.75 | AKR1B1 (0.54) | AKR1B1 | |
| SCHEMBL9870061 | 0.74 | AKR1B1 (0.77) | AKR1B1 | |
| SCHEMBL9870131 | 0.74 | AKR1B1 (0.67) | AKR1B1 | |
| SCHEMBL9872250 | 0.73 | AKR1B1 (0.57) | AKR1B1KDM4E | |
| SCHEMBL9871499 | 0.73 | AKR1B1 (0.65) | AKR1B1 | |
| SCHEMBL9870150 | 0.73 | AKR1B1 (0.54) | AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4996204-A | Antidiabetic agents | PFIZER INC. (US) | 1991-02-26 | — | — | US | disclosed |