Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8905468 | 0.99 | KMT2A (0.45) | KMT2ACTNNB1TCF7L2TRPA1CCNT1 | |
| SCHEMBL8889844 | 0.93 | NPY5R (0.48) | CCNT1CCNE1CDK2CDK9NPY5R | |
| SCHEMBL8893955 | 0.82 | NPY5R (0.40) | KMT2ACTNNB1TCF7L2CCNT1CCNE1 | |
| SCHEMBL8891133 | 0.81 | NPY5R (0.46) | CTNNB1TCF7L2TRPA1NPY5R | |
| SCHEMBL8900365 | 0.81 | SLC2A1 (0.49) | KMT2AALDH1A1MEN1NPY5RKDM4E | |
| SCHEMBL8890323 | 0.78 | NPY5R (0.45) | NPY5R | |
| Hydrochloric Acid SCHEMBL8890553 | 0.77 | NPY5R (0.44) | NPY5R | |
| SCHEMBL8898845 | 0.76 | NPY5R (0.41) | KMT2AALDH1A1MEN1NPY5RPOLB | |
| SCHEMBL8901142 | 0.76 | NPY5R (0.51) | NPY5R | |
| Hydrochloric Acid SCHEMBL8905477 | 0.75 | NPY5R (0.40) | KMT2AALDH1A1MEN1NPY5RPOLB |
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-1997020822-A1 | QUINAZOLIN-2,4-DIAZIRINES AS NPY RECEPTOR ANTAGONIST | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | claimed |