Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 1/20 | 0.57 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PI4KA | P42356 | 1/20 | 0.41 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | WNT1 | P04628 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14097462 | 0.84 | HTR1D (0.57) | HTR1DALOX5APCYP11B1CYP11B2WNT1 | |
| SCHEMBL25681517 | 0.80 | ALOX5AP (0.52) | HTR1DALOX5APCYP11B1CYP11B2PIK3CD | |
| SCHEMBL34467103 | 0.80 | ALOX5AP (0.52) | HTR1DALOX5APCYP11B1CYP11B2PIK3CD | |
| SCHEMBL6930946 | 0.74 | POLB (0.69) | TLR8POLBCYP1A2CYP2D6CXCR4 | |
| SCHEMBL12051554 | 0.74 | ALOX5AP (0.47) | ALOX5APCYP11B1CYP11B2PIK3CDPIP5K1C | |
| Hydrochloric Acid SCHEMBL6934113 | 0.73 | POLB (0.67) | TLR8POLBCYP1A2CYP2D6CXCR4 | |
| SCHEMBL7253103 | 0.72 | HTR1D (0.67) | HTR1DCYP11B1CYP11B2WNT1DYRK1A | |
| SCHEMBL7252900 | 0.72 | HTR1D (1.00) | HTR1DCYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL12051553 | 0.72 | ALOX5AP (0.49) | ALOX5APCYP11B1CYP11B2PIK3CDPIP5K1C | |
| SCHEMBL3450317 | 0.71 | AAK1 (0.58) | HTR1DALOX5APCYP11B1CYP11B2PIK3CD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7414046-B2 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-08-19 | — | — | US | disclosed |
| US-7414046-B2 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-08-19 | — | — | US | disclosed |
| US-RE40245-E1 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-04-15 | — | — | US | disclosed |
| US-RE40245-E1 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-04-15 | — | — | US | disclosed |
| EP-1341769-B1 | BACTERIAL GYRASE INHIBITORS AND USES THEREOF | VERTEX PHARMA (US) | 2007-10-17 | — | — | EP | disclosed |