Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.54 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CDC25B | P30305 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | WDR5 | P61964 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| Naphthoic Acid SCHEMBL11742303 | 0.89 | NR4A1 (0.70) | NR4A1NR4A2NR4A3CA1CA2 | |
| SCHEMBL1352722 | 0.82 | NOTUM (0.48) | ALDH1A1HPGDHTTKDM4ENOTUM | |
| SCHEMBL30675636 | 0.82 | NOTUM (0.48) | ALDH1A1HPGDHTTKDM4ENOTUM | |
| Naphthoic Acid SCHEMBL27788506 | 0.82 | NR4A1 (0.81) | NR4A1NR4A2NR4A3CDC25BALDH1A1 | |
| Naphthoic Acid SCHEMBL28188245 | 0.80 | NR4A1 (0.78) | NR4A1NR4A2NR4A3CDC25BALDH1A1 | |
| SCHEMBL12212891 | 0.79 | NR4A1 (0.52) | NR4A1NR4A2NR4A3CA1CA2 | |
| Naphthalene SCHEMBL27264766 | 0.78 | NR4A1 (0.59) | NR4A1NR4A2NR4A3CA1CA2 | |
| SCHEMBL27312206 | 0.78 | TSHR (0.53) | NR4A1NR4A2NR4A3CA1CA2 | |
| SCHEMBL59702 | 0.78 | CA1 (0.69) | CA1CA2ALDH1A1HPGDHTT | |
| SCHEMBL27637999 | 0.78 | NR4A1 (0.67) | NR4A1NR4A2NR4A3CDC25BALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102741251-B | Fused pyridine derivatives | KBP BIOSCIENCES CO LTD | 2015-03-25 | — | — | CN | disclosed |
| CN-102741251-A | Fused pyridine derivatives | SHANDONG XUANZHU MEDICINAL CO LTD | 2012-10-17 | — | — | CN | disclosed |
| CN-102127070-A | Pyridine cyclo-derivative | SHANDONG XUANZHU PHARMACEUTICAL CO LTD | 2011-07-20 | — | — | CN | disclosed |
| CN-102127071-A | Pyridine cyclo-derivative | SHANDONG XUANZHU PHARMACEUTICAL CO LTD | 2011-07-20 | — | — | CN | disclosed |
| CN-102127072-A | Pyridine cyclo-derivative | SHANDONG XUANZHU PHARMACEUTICAL CO LTD | 2011-07-20 | — | — | CN | disclosed |