Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 1/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.36 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.36 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.36 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | F2R | P25116 | 1/20 | 0.32 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.32 |
| ▸ | LSS | P48449 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8664139 | 0.82 | ABCC9 (0.37) | GRIA1GRIA2GRIA3GRIA4ABCC9 | |
| SCHEMBL8667527 | 0.80 | ABCC9 (0.51) | GRIA1GRIA2GRIA3GRIA4ABCC9 | |
| SCHEMBL8665101 | 0.75 | ABCC9 (0.37) | GRIA1GRIA2GRIA3GRIA4ABCC9 | |
| SCHEMBL7887143 | 0.75 | LOXL2 (0.47) | ABCC9ABCC8KCNJ11KCNJ8CYP2A6 | |
| SCHEMBL8666923 | 0.73 | CYP19A1 (0.32) | GRIA1GRIA2GRIA3GRIA4ABCC9 | |
| SCHEMBL15157661 | 0.67 | SLC6A4 (0.52) | GRIA1GRIA2GRIA3GRIA4CYP2A6 | |
| SCHEMBL8373592 | 0.64 | ABCC9 (0.51) | ABCC9ABCC8KCNJ11KCNJ8CXCR2 | |
| SCHEMBL24181391 | 0.63 | CYP2A6 (0.44) | GRIA1GRIA2GRIA3GRIA4CYP2A6 | |
| SCHEMBL21562627 | 0.63 | CYP2A6 (0.44) | GRIA1GRIA2GRIA3GRIA4CYP2A6 | |
| SCHEMBL7894157 | 0.63 | CXCR2 (0.39) | ABCC9ABCC8KCNJ11KCNJ8CXCR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5846999-A | Substituted N-arylmethylamino derivatives of cyclobutene-3,4-diones | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-12-08 | — | — | US | claimed |
| US-5846999-A | Substituted N-arylmethylamino derivatives of cyclobutene-3,4-diones | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-12-08 | — | — | US | disclosed |