Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.52 |
| ▸ | GPR132 | Q9UNW8 | 8/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.49 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6846506 | 0.88 | THRB (0.49) | MAPK1TSHRTHRBSIRT2SIRT1 | |
| SCHEMBL6846568 | 0.83 | GPR132 (0.55) | MAPK1TSHRGPR132NPC1RAB9A | |
| SCHEMBL7490334 | 0.82 | TRPV1 (0.52) | MAPK1TSHRTRPV1ALDH1A1 | |
| SCHEMBL6846921 | 0.74 | GPR132 (0.51) | MAPK1TSHRGPR132NPC1RAB9A | |
| SCHEMBL6841397 | 0.74 | RAB9A (0.65) | GPR132NPC1RAB9ASIRT2SIRT1 | |
| SCHEMBL28058986 | 0.73 | NR1H4 (0.71) | MAPK1TSHRGPR132NPC1RAB9A | |
| SCHEMBL6174341 | 0.72 | TSHR (0.75) | MAPK1TSHRALDH1A1 | |
| SCHEMBL6846707 | 0.72 | GPR132 (0.60) | MAPK1TSHRGPR132ALDH1A1 | |
| SCHEMBL6841278 | 0.72 | RAB9A (0.59) | GPR132NPC1RAB9ASIRT2SIRT1 | |
| SCHEMBL6079194 | 0.71 | SIRT2 (0.72) | RAB9ASIRT2SIRT1SIRT3 |
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-1252146-A1 | AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES | AGOURON PHARMACEUTICALS, INC. (US) | 2002-10-30 | — | — | EP | disclosed |
| WO-2001053274-A1 | AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES | AGOURON PHARMACEUTICALS, INC. (US) | 2001-07-26 | — | — | WO | disclosed |