Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.54 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.54 |
| ▸ | HTR3B | O95264 | 2/20 | 0.54 |
| ▸ | HTR3A | P46098 | 2/20 | 0.54 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.54 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.54 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.53 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | KCNQ2 | O43526 | 4/20 | 0.49 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL26423640 | 0.81 | HTR3E (0.67) | ALDH1A1KMT2AMEN1MAPK8HTR3E | |
| SCHEMBL1395822 | 0.81 | HTR3E (0.67) | ALDH1A1KMT2AMEN1MAPK8HTR3E | |
| SCHEMBL13181398 | 0.81 | KMT2A (0.48) | KMT2AHPGDSMN1; SMN2MAPK8SHMT1 | |
| SCHEMBL29481931 | 0.81 | MEN1 (0.61) | ALDH1A1KMT2AMEN1HPGDSMN1; SMN2 | |
| SCHEMBL17151448 | 0.81 | MEN1 (0.61) | ALDH1A1KMT2AMEN1HPGDSMN1; SMN2 | |
| SCHEMBL8858592 | 0.80 | MEN1 (0.59) | ALDH1A1KMT2AMEN1HPGDSMN1; SMN2 | |
| SCHEMBL924347 | 0.80 | MEN1 (0.59) | ALDH1A1KMT2AMEN1HPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL2175078 | 0.80 | HTR3E (0.65) | ALDH1A1KMT2AMEN1MAPK8HTR3E | |
| SCHEMBL7769258 | 0.80 | KMT2A (0.57) | ALDH1A1KMT2AMEN1HPGDEPHX2 | |
| SCHEMBL28992291 | 0.79 | ALDH1A1 (0.68) | ALDH1A1KMT2AMEN1HPGDSMN1; SMN2 |
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-1891064-B1 | N-AMIDE DERIVATIVES OF 8-AZABICYCLO[3.2.1]OCT-3-YL AS CCR1 ANTAGONISTS | ALMIRALL SA (ES) | 2009-09-02 | — | — | EP | disclosed |