Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | TEK | Q02763 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13997664 | 0.83 | MMP13 (0.40) | SMN1; SMN2HPGDHDAC3HDAC1HDAC2 | |
| SCHEMBL13253227 | 0.80 | SMN1; SMN2 (0.40) | SMN1; SMN2HPGDKMT2AMEN1RAB9A | |
| SCHEMBL16602197 | 0.78 | CALCRL (0.42) | SMN1; SMN2HPGD | |
| SCHEMBL13997473 | 0.78 | ADORA2A (0.35) | HPGDHDAC1KDM4EALDH1A1 | |
| SCHEMBL13997425 | 0.78 | ACHE (0.39) | HPGDKMT2AMAPTKDM4EALDH1A1 | |
| SCHEMBL13997661 | 0.77 | OPRM1 (0.40) | SMN1; SMN2HPGDKMT2AMEN1POLB | |
| SCHEMBL13997468 | 0.76 | NPC1 (0.43) | SMN1; SMN2HPGDRAB9AMAPTKDM4E | |
| SCHEMBL13997472 | 0.76 | P2RX7 (0.43) | SMN1; SMN2KMT2AMEN1HDAC1HDAC4 | |
| SCHEMBL13997475 | 0.76 | KLKB1 (0.33) | SMN1; SMN2HPGDKMT2ARAB9APOLB | |
| SCHEMBL13997663 | 0.75 | HTR2A (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008153849-A1 | CARBOXAMIDE HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2008-12-18 | — | — | WO | disclosed |