Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | STAT1 | P42224 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL5330388 | 0.82 | POLB (0.48) | HDAC1TP53RXFP1SMN1; SMN2MAPT | |
| SCHEMBL7454582 | 0.82 | MAPT (0.46) | HDAC1SMN1; SMN2MAPTPOLBL3MBTL1 | |
| SCHEMBL7454587 | 0.82 | HDAC1 (0.47) | HDAC1SMN1; SMN2MAPTPOLBL3MBTL1 | |
| SCHEMBL5315312 | 0.81 | P2RX7 (0.52) | MTNR1AMTNR1BNOTUMP2RX7BDKRB1 | |
| SCHEMBL16318517 | 0.81 | SETDB1 (0.51) | HDAC1MTNR1AMTNR1BRXFP1SMN1; SMN2 | |
| SCHEMBL17681591 | 0.79 | HDAC1 (0.42) | HDAC1SMN1; SMN2MAPTPOLBL3MBTL1 | |
| SCHEMBL2831744 | 0.79 | P2RX7 (0.56) | TP53MAPTP2RX7LMNA | |
| SCHEMBL4329523 | 0.78 | CNR1 (0.45) | MTNR1AMTNR1BNOTUMMAPTRAB9A | |
| SCHEMBL13537179 | 0.77 | MTNR1A (0.43) | MTNR1AMTNR1BNOTUMP2RX7RAB9A | |
| SCHEMBL20738728 | 0.76 | HDAC3 (0.54) | HDAC1MTNR1AMTNR1BSMN1; SMN2BDKRB1 |
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-2003077857-A2 | N-(SUBSTITUTED BENZYL)-8-HYDROXY-1,6-NAPHTHYRIDINE-7- CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2003-09-25 | — | — | WO | disclosed |