Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14387422 | 1.00 | NR1H4 (0.39) | NR1H4MAP4K4TSHRRECQLCHRM5 | |
| SCHEMBL8226012 | 0.96 | NR1H4 (0.40) | NR1H4MAP4K4TSHRRECQLCHRNB2 | |
| SCHEMBL8226114 | 0.96 | NR1H4 (0.40) | NR1H4MAP4K4TSHRRECQLCHRNB2 | |
| SCHEMBL16464581 | 0.85 | RAB9A (0.47) | NR1H4 | |
| SCHEMBL4082606 | 0.85 | RAB9A (0.47) | NR1H4 | |
| SCHEMBL3975733 | 0.85 | RAB9A (0.47) | NR1H4 | |
| SCHEMBL5483346 | 0.85 | RAB9A (0.48) | NR1H4 | |
| SCHEMBL2898408 | 0.85 | CASP3 (0.41) | NR1H4CHRM5CHRM3CHRM1CHRM2 | |
| SCHEMBL2899343 | 0.85 | RPS6KB1 (0.42) | NR1H4 | |
| SCHEMBL2898404 | 0.85 | CASP3 (0.41) | NR1H4CHRM5CHRM3CHRM1CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007130820-A2 | MGLUR5 MODULATORS I | ASTRAZENECA AB (SE) | 2007-11-15 | — | — | WO | disclosed |
| WO-2007130823-A2 | POLYCYCLIC HETEROCYCLIC COMPOUNDS AND THEIR USE AS MODULATORS OF THE METABOTROPIC GLUTAMATE 5 RECEPTOR | ASTRAZENECA AB (SE) | 2007-11-15 | — | — | WO | disclosed |