Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7992030 | 0.82 | GPR142 (0.49) | TP53TDP1CHRM2KDM4C | |
| SCHEMBL2861457 | 0.80 | CYP1A2 (1.00) | CYP1A2CYP2D6ALDH1A1NPSR1POLB | |
| Hydrochloric Acid SCHEMBL6121350 | 0.78 | CYP1A2 (0.95) | CYP1A2CYP2D6ALDH1A1NPSR1POLB | |
| SCHEMBL18157933 | 0.78 | KDM4C (0.42) | ALDH1A1NPSR1TDP1LMNAMAPK1 | |
| SCHEMBL8805346 | 0.76 | CYP1A2 (0.70) | CYP1A2CYP2D6ALDH1A1NPSR1POLB | |
| SCHEMBL10054984 | 0.76 | CYP1A2 (0.91) | CYP1A2CYP2D6ALDH1A1NPSR1POLB | |
| SCHEMBL7384057 | 0.76 | CYP1A2 (0.40) | CYP1A2CYP2D6ALDH1A1TDP1KDM4C | |
| SCHEMBL22304865 | 0.75 | CYP1A2 (0.88) | CYP1A2CYP2D6ALDH1A1NPSR1POLB | |
| SCHEMBL1042402 | 0.75 | CYP1A2 (0.88) | CYP1A2CYP2D6ALDH1A1NPSR1POLB | |
| SCHEMBL14931895 | 0.73 | CYP1A2 (0.84) | CYP1A2CYP2D6ALDH1A1NPSR1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-8557979-B2 | Carbapenem antibacterials with gram-negative activity and processes for their preparation | FOB SYNTHESIS, INC. (US) | 2013-10-15 | — | — | US | disclosed |
| US-8557979-B2 | Carbapenem antibacterials with gram-negative activity and processes for their preparation | FOB SYNTHESIS, INC. (US) | 2013-10-15 | — | — | US | disclosed |