Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.68 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.59 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.59 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.47 |
| ▸ | SELE | P16581 | 1/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.47 |
| ▸ | CCNC | P24863 | 1/20 | 0.47 |
| ▸ | CDK8 | P49336 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL851138 | 0.86 | CTNNB1 (0.51) | CTNNB1PARP10PARP15PARP2MAPT | |
| SCHEMBL8795188 | 0.84 | CTNNB1 (0.49) | CTNNB1PARP10PARP15PARP2MAPT | |
| SCHEMBL7695689 | 0.84 | CTNNB1 (0.62) | CTNNB1KDM4ESMN1; SMN2IRAK4 | |
| SCHEMBL3786236 | 0.83 | PARP15 (0.62) | CTNNB1PARP10PARP15PARP2MAPT | |
| SCHEMBL28876495 | 0.81 | CTNNB1 (1.00) | CTNNB1PARP10MAPTMEN1LMNA | |
| SCHEMBL27680126 | 0.81 | CTNNB1 (1.00) | CTNNB1PARP10MAPTMEN1LMNA | |
| SCHEMBL5724 | 0.81 | CTNNB1 (1.00) | CTNNB1PARP10MAPTMEN1LMNA | |
| SCHEMBL27800575 | 0.80 | CTNNB1 (0.77) | CTNNB1PARP10MAPTMEN1LMNA | |
| SCHEMBL1892492 | 0.80 | CTNNB1 (0.77) | CTNNB1PARP10MAPTKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL50731 | 0.80 | CTNNB1 (0.96) | CTNNB1PARP10MAPTMEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002016356-A2 | QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | claimed |
| WO-2002016357-A2 | QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | disclosed |