Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | PRKCI | P41743 | 5/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.35 |
| ▸ | GRK2 | P25098 | 4/20 | 0.35 |
| ▸ | LATS1 | O95835 | 2/20 | 0.35 |
| ▸ | LATS2 | Q9NRM7 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11000644 | 0.81 | GSK3B (0.40) | PDE3BPDE3APRKCILATS1LATS2 | |
| SCHEMBL11004647 | 0.80 | ADORA2A (0.39) | PRKCILATS1LATS2ADORA2AADORA1 | |
| SCHEMBL14938324 | 0.78 | LATS1 (0.34) | PRKCIROCK2LATS1LATS2ADORA2A | |
| SCHEMBL11005615 | 0.78 | ADORA2A (0.33) | PRKCIROCK2GRK2LATS1LATS2 | |
| SCHEMBL12006474 | 0.77 | BMPR1B (0.42) | NPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL11003505 | 0.77 | GSK3B (0.43) | PRKCILATS1LATS2ADORA2AADORA1 | |
| SCHEMBL11006980 | 0.77 | MAPK14 (0.41) | LATS1LATS2ADORA2AADORA1NPC1 | |
| SCHEMBL11005247 | 0.77 | BRAF (0.41) | PRKCIROCK2LATS1LATS2NPC1 | |
| SCHEMBL11004943 | 0.76 | ALDH1A1 (0.41) | LATS1LATS2ADORA2AADORA1NPC1 | |
| SCHEMBL12472696 | 0.75 | ADORA2A (0.33) | ADORA2AADORA1ALDH1A1MAPTADORA3 |
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-4503228-A | 2-(Pyridinyl)-4,5,6-pyrimidinetriamines | STERLING DRUG INC. (US) | 1985-03-05 | — | — | US | disclosed |
| US-4473571-A | 8-Substituted-2-(4-pyridinyl)-9H-purin-6-amines and their cardiotonic use | STERLING DRUG INC. (US) | 1984-09-25 | — | — | US | disclosed |