Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LTA4H | P09960 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TTR | P02766 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | TSPO | P30536 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 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 | |
|---|---|---|---|---|
| SCHEMBL11442190 | 0.81 | CA1 (0.55) | ALDH1A1MAPK1HTTL3MBTL1LMNA | |
| SCHEMBL4596133 | 0.80 | MAPK1 (0.59) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL9139036 | 0.77 | HTT (0.50) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL11447751 | 0.76 | ALDH1A1 (0.59) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL27468784 | 0.76 | DPP4 (0.54) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL6900858 | 0.76 | ALDH1A1 (0.48) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL791852 | 0.74 | HTT (0.86) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL9411633 | 0.73 | HTT (0.50) | ALDH1A1MAPK1HTTL3MBTL1LTA4H | |
| SCHEMBL11449754 | 0.72 | CTNNB1 (0.48) | ALDH1A1HTTLTA4HLMNAKMT2A | |
| SCHEMBL11441965 | 0.72 | ADORA2A (0.53) | HTTLTA4HBRD4LMNAKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4183955-A | Troponyl-oxamic acid derivatives for treating allergic conditions | Ayerst. McKenna & Harrison Limited (CA) | 1980-01-15 | — | — | US | disclosed |
| US-4125625-A | ANTIALLERGENS | AYERST, MCKENNA & HARRISON LIMITED (CA) | 1978-11-14 | — | — | US | disclosed |
| US-4057556-A | ANTIALLERGENS | AYERST, MCKENNA & HARRISON LTD. (CA) | 1977-11-08 | — | — | US | disclosed |