Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY6 | Q15077 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 3/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.35 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8603312 | 0.85 | P2RY6 (0.47) | P2RY6HSD17B10TPSAB1PRSS1CHRM1 | |
| SCHEMBL7686611 | 0.83 | KMT2A (0.53) | P2RY6HSD17B10TPSAB1PRSS1CHRM1 | |
| SCHEMBL8578080 | 0.80 | P2RY6 (0.42) | P2RY6HSD17B10TPSAB1PRSS1KMT2A | |
| SCHEMBL6432262 | 0.75 | P2RY6 (0.50) | P2RY6HSD17B10TPSAB1PRSS1CHRM1 | |
| SCHEMBL8575681 | 0.75 | MCL1 (0.60) | P2RY6HSD17B10TPSAB1PRSS1CHRM1 | |
| SCHEMBL19763089 | 0.74 | KMT2A (0.61) | KMT2AMEN1PKM | |
| SCHEMBL8573694 | 0.74 | EPHX2 (0.47) | TPSAB1KMT2AMEN1CA1CA2 | |
| SCHEMBL3923947 | 0.73 | P2RY6 (0.52) | P2RY6HSD17B10TPSAB1PRSS1CHRM1 | |
| SCHEMBL343680 | 0.72 | GAA (0.49) | P2RY6CA1CA2 | |
| SCHEMBL14579478 | 0.71 | KDM4E (0.58) | P2RY6HSD17B10 |
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-1998016826-A1 | IMMUNOASSAY FOR THE DETECTION AND MEASUREMENT OF 2,2-DIBROMO-3-NITRILOPROPIONAMIDE | THE DOW CHEMICAL COMPANY (US) | 1998-04-23 | — | — | WO | disclosed |