Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.42 |
| ▸ | PRKCA | P17252 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL295552 | 0.84 | ALDH1A1 (0.57) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL12482627 | 0.81 | ALDH1A1 (0.53) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL514540 | 0.78 | LMNA (0.60) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL9084045 | 0.78 | ALDH1A1 (0.57) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL9538272 | 0.77 | ALDH1A1 (0.49) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL4415878 | 0.77 | ALDH1A1 (0.65) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL27933653 | 0.76 | TSHR (0.45) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL12190874 | 0.74 | ALDH1A1 (0.61) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL13120035 | 0.74 | ALDH1A1 (0.66) | ALDH1A1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL9963976 | 0.74 | ALDH1A1 (0.61) | ALDH1A1ADRB2ADRB1ADRB3LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101679244-B | 5-membered heterocyclic derivative and use thereof for medical purposes | KISSEI PHARMACEUTICAL | 2014-01-01 | — | — | CN | disclosed |