Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL259818 | 0.83 | TSHR (0.43) | CNR2PLA2G2AMAPTPOLBHTT | |
| SCHEMBL3686573 | 0.77 | TDP1 (0.40) | CNR2PLA2G2AMAPTNPSR1LMNA | |
| SCHEMBL2034006 | 0.74 | CNR2 (0.50) | CNR2MAPTTSHRALDH1A1 | |
| SCHEMBL1538812 | 0.72 | NR4A2 (0.66) | LMNAKMT2ANR4A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL3690830 | 0.72 | MCL1 (0.39) | CNR2PLA2G2AMAPTLMNAKMT2A | |
| SCHEMBL24735736 | 0.69 | CNR2 (0.44) | CNR2MAPTHTTTSHRALDH1A1 | |
| SCHEMBL260983 | 0.68 | GAA (0.44) | CNR2PLA2G2AMAPTLMNAKMT2A | |
| SCHEMBL1694617 | 0.67 | ALDH1A1 (0.61) | MAPTKMT2AHTTTSHRALDH1A1 | |
| SCHEMBL15180828 | 0.67 | ALDH1A1 (0.61) | MAPTKMT2AHTTTSHRALDH1A1 | |
| SCHEMBL12485068 | 0.67 | CHRM1 (0.53) | CNR2NPSR1LMNAPOLBHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-7968540-B2 | Spirohydantoin tricyclic CGRP receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2011-06-28 | — | — | US | disclosed |
| US-7947677-B2 | Spirolactam tricyclic CGRP receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2011-05-24 | — | — | US | disclosed |