Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDR | P35968 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | OTUD7B | Q6GQQ9 | 1/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | PTGES | O14684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5852278 | 0.99 | MAPT (0.46) | MAPTSMN1; SMN2KDRNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3846532 | 0.89 | DYRK1A (0.45) | NPC1RAB9AOTUD7BHSD17B1HSD17B2 | |
| SCHEMBL4712318 | 0.83 | KDM4E (0.41) | MAPTPOLBLRRK2KDM4EROCK2 | |
| Hydrochloric Acid SCHEMBL3849122 | 0.83 | KDM4E (0.40) | MAPTPOLBLRRK2KDM4EROCK2 | |
| Hydrochloric Acid SCHEMBL3845647 | 0.83 | LRRK2 (0.45) | NPC1RAB9ATDP1LRRK2KDM4E | |
| Hydrochloric Acid SCHEMBL3850519 | 0.82 | GSK3B (0.42) | SMN1; SMN2NPC1RAB9AROCK2DYRK1A | |
| SCHEMBL3855822 | 0.82 | FLT3 (0.41) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL3851356 | 0.82 | KDR (0.46) | MAPTSMN1; SMN2KDRNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL5853314 | 0.81 | FLT3 (0.41) | MAPTNPC1RAB9APOLBMEN1 | |
| Hydrochloric Acid SCHEMBL3849246 | 0.81 | FLT3 (0.39) | SMN1; SMN2NPC1RAB9AROCK2 |
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-2048142-A2 | Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof | Eisai R&D Management Co., Ltd. (JP) | 2009-04-15 | — | — | EP | disclosed |
| EP-1382603-B1 | NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF | EISAI R&D MAN CO LTD (JP) | 2008-07-23 | — | — | EP | disclosed |