Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | EDNRB | P24530 | 1/20 | 0.39 |
| ▸ | EDNRA | P25101 | 1/20 | 0.39 |
| ▸ | MDM4 | O15151 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1827704 | 1.00 | KCNN4 (0.53) | KCNN4HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL3934832 | 1.00 | KCNN4 (0.53) | KCNN4HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL21229775 | 0.87 | KCNN4 (0.55) | KCNN4HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL1492782 | 0.83 | KCNN4 (0.55) | KCNN4HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL14815251 | 0.81 | CES2 (0.52) | CES2TP53HTTRAB9A | |
| SCHEMBL9044136 | 0.81 | KCNN4 (0.53) | KCNN4HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL31560818 | 0.81 | KCNN4 (0.53) | KCNN4HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL524825 | 0.81 | KCNN4 (0.56) | KCNN4HDAC1HDAC6CES2CES1 | |
| SCHEMBL29798769 | 0.81 | KCNN4 (0.56) | KCNN4HDAC1HDAC6CES2CES1 | |
| SCHEMBL27588944 | 0.81 | RXRA (0.50) | HDAC6HDAC3HDAC2CYP1A2CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1578910-A4 | NITRILASES | VERENIUM CORP (US) | 2008-06-04 | — | — | EP | disclosed |
| EP-1578910-A2 | NITRILASES | DIVERSA CORPORATION (US) | 2005-09-28 | — | — | EP | disclosed |
| WO-2003000840-A2 | NITRILASES | DIVERSA CORPORATION (US) | 2003-01-03 | — | — | WO | disclosed |