Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC9 | O60706 | 1/20 | 0.54 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.54 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.54 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.54 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 3/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 4/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | PRKACA | P17612 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7887074 | 0.88 | ABCC9 (0.71) | ABCC9ABCC8KCNJ11KCNJ8RPS6KB1 | |
| SCHEMBL7895223 | 0.82 | ABCC9 (0.51) | ABCC9ABCC8KCNJ11KCNJ8KDM4C | |
| SCHEMBL7887121 | 0.82 | ABCC9 (0.43) | ABCC9ABCC8KCNJ11KCNJ8KDM4C | |
| SCHEMBL7898502 | 0.80 | ABCC9 (0.41) | ABCC9ABCC8KCNJ11KCNJ8KDM4C | |
| SCHEMBL7894087 | 0.79 | LOXL2 (0.50) | ABCC9ABCC8KCNJ11KCNJ8CYP2A6 | |
| SCHEMBL7895748 | 0.75 | ABCC9 (0.61) | ABCC9ABCC8KCNJ11KCNJ8IDH1 | |
| SCHEMBL7895591 | 0.74 | ABCC9 (0.60) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL7895113 | 0.74 | ABCC9 (0.60) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL8414670 | 0.74 | LRRK2 (0.42) | ABCC9ABCC8KCNJ11KCNJ8CXCR2 | |
| SCHEMBL13824727 | 0.73 | CYP2A6 (0.52) | ABCC9ABCC8KCNJ11KCNJ8KDM4C |
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-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | claimed |
| US-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | disclosed |