Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 6/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3082743 | 0.89 | HRH1 (0.46) | CYP2A6HRH1CXCR4CHRNA7 | |
| SCHEMBL13095176 | 0.81 | HRH1 (0.44) | CYP2A6HRH1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL3081098 | 0.78 | CYP2A6 (0.40) | CYP2A6HRH1CXCR4HTR2ACHRNA7 | |
| SCHEMBL8735931 | 0.75 | TLR8 (0.47) | CYP2A6HRH1L3MBTL1TDP1TLR8 | |
| SCHEMBL13095210 | 0.74 | ALDH1A1 (0.38) | HRH1L3MBTL1TDP1ALDH1A1HPGD | |
| SCHEMBL253769 | 0.73 | L3MBTL1 (0.40) | CYP2A6L3MBTL1TDP1NPC1ALDH1A1 | |
| Phosphoric Acid SCHEMBL28641959 | 0.73 | PDE3B (0.35) | L3MBTL1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL19865639 | 0.73 | L3MBTL1 (0.42) | L3MBTL1TDP1NPC1ALDH1A1HPGD | |
| SCHEMBL510211 | 0.73 | CYP2C9 (0.43) | L3MBTL1TDP1HPGDTLR8CXCR4 | |
| SCHEMBL8764979 | 0.73 | L3MBTL1 (0.42) | L3MBTL1TDP1NPC1ALDH1A1HPGD |
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-2205600-A1 | CARBACEPHEM ß -LACTAM ANTIBIOTICS | Achaogen, Inc. (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2010030811-A2 | CARBACEPHEM β-LACTAM ANTIBIOTICS | ACHAOGEN, INC. (US) | 2010-03-18 | — | — | WO | disclosed |
| WO-2009055696-A1 | CARBACEPHEM β-LACTAM ANTIBIOTICS | ACHAOGEN, INC. (US) | 2009-04-30 | — | — | WO | disclosed |