Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | CXCR5 | P32302 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 2/20 | 0.32 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939579 | 0.81 | SRD5A1 (0.36) | CA1CA2CA7CA9LMNA | |
| SCHEMBL14939748 | 0.81 | CA1 (0.43) | CA1CA2CA7CA9MEN1 | |
| SCHEMBL14939135 | 0.75 | ALDH1A1 (0.40) | CA1CA2CA7CA9LMNA | |
| SCHEMBL14938940 | 0.75 | NPSR1 (0.49) | LMNAKMT2ASMN1; SMN2NPSR1HTT | |
| SCHEMBL14430321 | 0.73 | CA1 (0.42) | CA1CA2CA7CA9GRIA1 | |
| SCHEMBL16290337 | 0.71 | CA1 (0.41) | CA1CA2CA7CA9GRIA1 | |
| SCHEMBL14939198 | 0.71 | ESR1 (0.40) | CA1CA2CA7CA9LMNA | |
| SCHEMBL14939457 | 0.71 | NPSR1 (0.49) | LMNAMEN1KMT2ABACE1SMN1; SMN2 | |
| SCHEMBL14939269 | 0.71 | LMNA (0.42) | CA1CA2CA7CA9LMNA | |
| SCHEMBL14939574 | 0.70 | MAPT (0.41) | LMNAMEN1KMT2ASMN1; SMN2NPSR1 |
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-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |