Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | NCF1 | P14598 | 1/20 | 0.34 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | F10 | P00742 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.32 |
| ▸ | MC4R | P32245 | 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 | |
|---|---|---|---|---|
| SCHEMBL8699754 | 0.91 | L3MBTL1 (0.36) | L3MBTL1CA12CA1CA2CA9 | |
| SCHEMBL8632400 | 0.78 | MEN1 (0.39) | CA12CA1CA2CA9RORC | |
| SCHEMBL8634739 | 0.75 | CA12 (0.41) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL8633897 | 0.74 | HRH3 (0.35) | ADRB2NCF1PLD1CHRM1F10 | |
| SCHEMBL8637013 | 0.66 | ITGB3 (0.38) | RORCADRB2NCF1PLD1CHRM1 | |
| SCHEMBL8634130 | 0.66 | ITGB3 (0.39) | RORCADRB2NCF1PLD1CHRM1 | |
| SCHEMBL8633916 | 0.65 | ADRB2 (0.35) | ADRB2NCF1PLD1CHRM1F10 | |
| SCHEMBL3440218 | 0.65 | CYP2C9 (0.45) | F10ITGB3ITGA2B | |
| SCHEMBL6791781 | 0.63 | ITGB3 (0.57) | ADRB2NCF1PLD1CHRM1KMT2A | |
| SCHEMBL8701123 | 0.63 | ADRB2 (0.42) | ADRB2NCF1PLD1MAPTITGB3 |
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-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |