Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | TTR | P02766 | 3/20 | 0.50 |
| ▸ | BRD4 | O60885 | 2/20 | 0.50 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11439546 | 0.84 | CA1 (0.67) | ALDH1A1MAPK1HTTL3MBTL1RAB9A | |
| SCHEMBL791852 | 0.82 | HTT (0.86) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL11439501 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL11447548 | 0.75 | GAA (0.50) | ALDH1A1HTTBRD4LTA4HKMT2A | |
| SCHEMBL4596133 | 0.75 | MAPK1 (0.59) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL17970735 | 0.75 | ALDH1A1 (0.59) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL7526163 | 0.75 | ALDH1A1 (0.59) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL3627857 | 0.75 | HTT (1.00) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL11208196 | 0.74 | MAPK1 (0.58) | ALDH1A1MAPK1HTTL3MBTL1TTR | |
| SCHEMBL51822 | 0.74 | LTA4H (0.69) | ALDH1A1MAPK1HTTL3MBTL1LTA4H |
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 |