Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 13/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12807324 | 1.00 | ACACB (0.53) | ACACBGAARAB9ALTA4HMEN1 | |
| SCHEMBL22604651 | 1.00 | ACACB (0.53) | ACACBGAARAB9ALTA4HMEN1 | |
| Hydrochloric Acid SCHEMBL4363490 | 0.98 | ACACB (0.52) | ACACBGAARAB9ALTA4HMEN1 | |
| Hydrochloric Acid SCHEMBL4363494 | 0.98 | ACACB (0.52) | ACACBGAARAB9ALTA4HMEN1 | |
| SCHEMBL15593940 | 0.89 | ACACB (0.51) | ACACBMEN1LMNACYP1A2KMT2A | |
| SCHEMBL12473156 | 0.88 | ACACB (0.55) | ACACBLTA4HCYP1A2 | |
| SCHEMBL13126082 | 0.88 | ACACB (0.55) | ACACBLTA4HCYP1A2 | |
| SCHEMBL10084808 | 0.88 | ACACB (0.55) | ACACBLTA4HCYP1A2 | |
| Hydrochloric Acid SCHEMBL16816179 | 0.87 | ACACB (0.54) | ACACBLTA4HCYP1A2 | |
| Hydrochloric Acid SCHEMBL16816182 | 0.87 | ACACB (0.54) | ACACBLTA4HCYP1A2 |
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-2020216240-A1 | DICYCLIC ALKANE COMPOUND USEFUL AS INHIBITOR OF PLASMA KALLIKREIN | 南京明德新药研发有限公司 | 2020-10-29 | — | — | WO | disclosed |