Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | GNRHR | P30968 | 1/20 | 0.40 |
| ▸ | PREP | P48147 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL15534872 | 1.00 | CCNA2 (0.45) | CCNA2CDK2CHRM1CHRM3CRBN | |
| SCHEMBL15535202 | 0.81 | GNRHR (0.48) | CNR1CNR2GNRHR | |
| SCHEMBL15535203 | 0.81 | GNRHR (0.48) | CNR1CNR2GNRHR | |
| SCHEMBL1666506 | 0.81 | ALDH1A1 (0.48) | CHRM1CNR1CNR2GNRHRHDAC1 | |
| SCHEMBL12798265 | 0.81 | ALDH1A1 (0.48) | CHRM1CNR1CNR2GNRHRHDAC1 | |
| SCHEMBL1668907 | 0.81 | ALDH1A1 (0.48) | CHRM1CNR1CNR2GNRHRHDAC1 | |
| SCHEMBL11893819 | 0.81 | ALDH1A1 (0.48) | CHRM1CNR1CNR2GNRHRHDAC1 | |
| SCHEMBL15534659 | 0.79 | GNRHR (0.44) | CNR1CNR2GNRHRHDAC1HDAC6 | |
| SCHEMBL15534658 | 0.79 | GNRHR (0.44) | CNR1CNR2GNRHRHDAC1HDAC6 | |
| Acetic Acid SCHEMBL11893957 | 0.78 | ALDH1A1 (0.46) | CHRM1GNRHRHDAC1HDAC6HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013177349-A2 | QUINAZOLINEDIONES AS TANKYRASE INHIBITORS | GLAXOSMITHKLINE LLC (US) | 2013-11-28 | — | — | WO | disclosed |