Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP15 | Q460N3 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24807695 | 0.80 | DPP4 (0.39) | KMT2ASMN1; SMN2NPC1GAARAB9A | |
| SCHEMBL31362139 | 0.80 | NQO2 (0.37) | MAPK1SMN1; SMN2NPC1GAARAB9A | |
| SCHEMBL26626466 | 0.80 | NQO2 (0.37) | MAPK1SMN1; SMN2NPC1GAARAB9A | |
| SCHEMBL14540255 | 0.80 | DYRK1A (0.39) | MAPK1SMN1; SMN2NPC1GAARAB9A | |
| SCHEMBL16626055 | 0.80 | POLB (0.38) | MAPK1SMN1; SMN2NPC1GAARAB9A | |
| Hydrochloric Acid SCHEMBL26626474 | 0.79 | DYRK1A (0.38) | MAPK1SMN1; SMN2NPC1GAARAB9A | |
| Hydrochloric Acid SCHEMBL30716710 | 0.79 | DYRK1A (0.38) | MAPK1SMN1; SMN2NPC1GAARAB9A | |
| SCHEMBL17563255 | 0.72 | DPP4 (0.36) | KMT2AMEN1GAAKDM4EDPP4 | |
| SCHEMBL10976101 | 0.71 | LMNA (0.38) | KMT2AMEN1SMN1; SMN2NPC1GAA | |
| SCHEMBL434799 | 0.71 | NPC1 (0.58) | KMT2ASMN1; SMN2NPC1GAARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-7528129-B2 | CGRP-antagonists, process for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-05-05 | — | — | US | disclosed |