Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | TNF | P01375 | 4/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4887298 | 0.85 | ALDH1A1 (0.39) | ALDH1A1MAPTPOLBCDK9NPC1 | |
| SCHEMBL4642278 | 0.84 | ALDH1A1 (0.39) | ALDH1A1MAPTPOLBCDK9NPC1 | |
| SCHEMBL4775013 | 0.83 | ALDH1A1 (0.38) | ALDH1A1MAPTPOLBCDK9NPC1 | |
| SCHEMBL4641222 | 0.83 | MTNR1A (0.45) | ALDH1A1MAPTPOLBCDK9NPC1 | |
| SCHEMBL4890412 | 0.79 | ALDH1A1 (0.39) | ALDH1A1MAPTPOLBCDK9NPC1 | |
| SCHEMBL4907499 | 0.79 | NPC1 (0.45) | ALDH1A1MAPTPOLBNPC1RAB9A | |
| SCHEMBL4640258 | 0.78 | BRD4 (0.35) | ALDH1A1MAPTPOLBCDK9TNF | |
| SCHEMBL4914665 | 0.77 | ALDH1A1 (0.40) | ALDH1A1MAPTPOLBCDK9NPC1 | |
| SCHEMBL4641876 | 0.77 | AAK1 (0.35) | ALDH1A1CDK9TNFBRD4HPGD | |
| SCHEMBL4640617 | 0.77 | ALDH1A1 (0.40) | ALDH1A1MAPTPOLBCDK9NPC1 |
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-1945304-A2 | IMIDAZO-PYRIDINE CONTAINING BETA AGONISTS, METHOD FOR PRODUCING THEM AND THEIR USE AS DRUGS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007048843-A2 | IMIDAZO-PYRIDINE CONTAINING BETA AGONISTS, METHOD FOR PRODUCING THEM AND THEIR USE AS DRUGS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-05-03 | — | — | WO | disclosed |