Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL7407020 | 0.89 | SMN1; SMN2 (0.73) | SMN1; SMN2L3MBTL1MAPK1KDM4ETSHR | |
| SCHEMBL9633992 | 0.86 | KDM4E (0.52) | SMN1; SMN2L3MBTL1TDP1MAPK1KDM4E | |
| SCHEMBL30416454 | 0.83 | SMN1; SMN2 (0.59) | SMN1; SMN2L3MBTL1TDP1MAPK1TSHR | |
| SCHEMBL24096249 | 0.82 | TAAR1 (0.48) | SMN1; SMN2MAPK1KDM4EHTR1BPLAU | |
| SCHEMBL1619631 | 0.81 | SMN1; SMN2 (0.52) | SMN1; SMN2L3MBTL1TDP1MAPK1KDM4E | |
| SCHEMBL13617359 | 0.81 | SMN1; SMN2 (0.57) | SMN1; SMN2L3MBTL1TDP1MAPK1KDM4E | |
| Hydrochloric Acid SCHEMBL7484053 | 0.81 | KDM4E (0.52) | SMN1; SMN2MAPK1KDM4EHTR1BRAB9A | |
| Hydrochloric Acid SCHEMBL25376194 | 0.79 | SMN1; SMN2 (0.55) | SMN1; SMN2L3MBTL1TDP1MAPK1KDM4E | |
| SCHEMBL12099001 | 0.79 | SMN1; SMN2 (0.63) | SMN1; SMN2L3MBTL1MAPK1KDM4ETSHR | |
| SCHEMBL29669870 | 0.78 | NFE2L2 (0.50) | SMN1; SMN2L3MBTL1TDP1MAPK1KDM4E |
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-1888538-B1 | (3,4-DIHYDRO-QUINAZOLIN-2-YL)-(2-ARYLOXY-ETHYL)-AMINES HAVING AN ACTIVITY ON THE 5-HT RECEPTOR | HOFFMANN LA ROCHE (CH) | 2009-11-18 | — | — | EP | disclosed |