Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3579176 | 0.87 | LIPG (0.41) | LIPGCTSSCTSKACACBCA2 | |
| SCHEMBL2712266 | 0.83 | LIPG (0.49) | LIPGACACBCA2KCNH2SLC22A1 | |
| SCHEMBL2712262 | 0.83 | LIPG (0.49) | LIPGACACBCA2KCNH2SLC22A1 | |
| SCHEMBL14661034 | 0.82 | LIPG (0.45) | LIPGACACBCA2KCNH2SLC22A1 | |
| SCHEMBL1810822 | 0.81 | ATM (0.39) | CTSSCTSKACACBCA2AAK1 | |
| SCHEMBL4308178 | 0.79 | LIPG (0.44) | LIPGACACBCA2KCNH2SLC22A1 | |
| SCHEMBL10981741 | 0.79 | CTSK (0.62) | CTSSCTSKHTTKDM4ECYP1A2 | |
| SCHEMBL10974978 | 0.79 | CTSK (0.62) | CTSSCTSKHTTKDM4ECYP1A2 | |
| SCHEMBL28733236 | 0.79 | CTSK (0.62) | CTSSCTSKHTTKDM4ECYP1A2 | |
| SCHEMBL27741108 | 0.79 | CTSK (0.47) | CTSSCTSKCA2HTTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011005527-A2 | KETOREDUCTASE-MEDIATED STEREOSELECTIVE ROUTE TO ALPHA CHLOROALCOHOLS | CODEXIS, INC. (US) | 2011-01-13 | — | — | WO | claimed |
| WO-2011005527-A2 | KETOREDUCTASE-MEDIATED STEREOSELECTIVE ROUTE TO ALPHA CHLOROALCOHOLS | CODEXIS, INC. (US) | 2011-01-13 | — | — | WO | disclosed |