Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 4/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19286604 | 0.84 | TSHR (0.53) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL16579480 | 0.78 | TP53 (0.44) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL24574648 | 0.72 | ALDH1A1 (0.38) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL4280056 | 0.71 | MAPT (0.43) | HTTSMN1; SMN2MAPTKDM4EMEN1 | |
| SCHEMBL10066103 | 0.69 | PTGS2 (0.51) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL1198707 | 0.68 | LMNA (0.49) | ALDH1A1HTTLMNAMAPTRAB9A | |
| SCHEMBL11964122 | 0.67 | L3MBTL1 (0.55) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL24184142 | 0.66 | ALDH1A1 (0.41) | ALDH1A1LMNAMAPTCYP1A2CYP3A4 | |
| SCHEMBL8784355 | 0.66 | PTGS1 (0.53) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL1550906 | 0.66 | NPBWR1 (0.59) | HTTSMN1; SMN2NPSR1NPBWR1MCHR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |