Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7843692 | 0.87 | TDP2 (0.40) | TDP2CYP17A1KDM4ESMN1; SMN2HDAC3 | |
| SCHEMBL7846042 | 0.85 | CYP17A1 (0.34) | TDP2CYP17A1KDM4ESMN1; SMN2TRPV1 | |
| SCHEMBL7843840 | 0.78 | HRH2 (0.34) | TDP2KDM4E | |
| SCHEMBL7846853 | 0.76 | CYP17A1 (0.41) | TDP2CYP17A1SIRT1KDM4EALDH1A1 | |
| SCHEMBL7236713 | 0.74 | NPFFR1 (0.35) | TDP2CYP17A1KDM4ETRPV1ALDH1A1 | |
| SCHEMBL7230492 | 0.72 | MAP4K4 (0.43) | ALDH1A1NPC1POLB | |
| SCHEMBL7841418 | 0.71 | CYP17A1 (0.42) | TDP2CYP17A1TRPV1HDAC1NPC1 | |
| SCHEMBL7842830 | 0.70 | CYP17A1 (0.41) | TDP2CYP17A1KDM4EALDH1A1HDAC3 | |
| SCHEMBL23455338 | 0.70 | NPC1 (0.48) | SMN1; SMN2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL30001020 | 0.70 | NPC1 (0.48) | SMN1; SMN2ALDH1A1NPC1RAB9APOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1157022-A1 | PYRIDINE COMPOUNDS AND THEIR PHARMACEUTICAL USE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-11-28 | — | — | EP | disclosed |
| WO-2000049015-A1 | PYRIDINE COMPOUNDS AND THEIR PHARMACEUTICAL USE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-08-24 | — | — | WO | disclosed |