Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.54 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NNMT | P40261 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2671576 | 0.86 | KDM4E (0.54) | MTNR1AMTNR1BALDH1A1KMT2AGAA | |
| SCHEMBL4137126 | 0.82 | MTNR1A (0.47) | MTNR1AMTNR1BALDH1A1HDAC3HDAC4 | |
| SCHEMBL2671191 | 0.80 | HSD17B2 (0.52) | MTNR1AMTNR1BALDH1A1KMT2AMAPT | |
| SCHEMBL25804157 | 0.79 | HPGD (0.46) | ALDH1A1KMT2AHPGDNNMTMAPT | |
| SCHEMBL30134289 | 0.79 | HPGD (0.46) | ALDH1A1KMT2AHPGDNNMTMAPT | |
| SCHEMBL30133957 | 0.79 | SMN1; SMN2 (0.44) | ALDH1A1KMT2AHPGDNNMTMAPT | |
| SCHEMBL9015187 | 0.77 | CYP1A2 (0.53) | CYP2A6ALDH1A1KMT2AHPGDMAPT | |
| SCHEMBL8148257 | 0.76 | CYP2A6 (0.44) | CYP2A6ALDH1A1KMT2AGAAHPGD | |
| SCHEMBL8156878 | 0.76 | ALDH1A1 (0.43) | CYP2A6ALDH1A1KMT2AGAAHPGD | |
| SCHEMBL4403749 | 0.75 | PLAU (0.52) | CYP2A6ALDH1A1KMT2AHPGDMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012056372-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-05-03 | — | — | WO | disclosed |