Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCA | P06881 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | DCTPP1 | Q9H773 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4058921 | 0.83 | CALCA (0.51) | CALCAKCNH2KMT2ADCTPP1SMN1; SMN2 | |
| SCHEMBL7012536 | 0.82 | CALCA (0.51) | CALCAKCNH2KMT2ADCTPP1SMN1; SMN2 | |
| SCHEMBL4064942 | 0.76 | CALCA (0.56) | CALCAKCNH2KMT2ADCTPP1SMN1; SMN2 | |
| SCHEMBL4064947 | 0.76 | CALCA (0.54) | CALCAKCNH2KMT2ADCTPP1SMN1; SMN2 | |
| SCHEMBL4059015 | 0.76 | CALCA (0.50) | CALCAKCNH2KMT2ADCTPP1SMN1; SMN2 | |
| SCHEMBL4059233 | 0.74 | CALCA (0.50) | CALCAKCNH2KMT2ADCTPP1SMN1; SMN2 | |
| SCHEMBL4060841 | 0.74 | CALCA (0.55) | CALCAKCNH2KMT2ASMN1; SMN2CYP2C9 | |
| SCHEMBL4062571 | 0.73 | CALCA (0.52) | CALCAKCNH2KMT2ASMN1; SMN2ERCC1 | |
| SCHEMBL4059314 | 0.73 | CALCA (0.50) | CALCAKMT2ASMN1; SMN2ERCC1FEN1 | |
| SCHEMBL4060900 | 0.73 | CALCA (0.54) | CALCAKCNH2KMT2ASMN1; SMN2CYP2C9 |
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-1326865-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002030931-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2002-04-18 | — | — | WO | disclosed |
| WO-2002030930-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2002-04-18 | — | — | WO | disclosed |