Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12772857 | 0.91 | MAPT (0.47) | MAPTALDH1A1KDM4EPOLB | |
| SCHEMBL12881572 | 0.87 | ALDH1A1 (0.43) | MAPTALDH1A1KDM4E | |
| SCHEMBL12881583 | 0.82 | ALDH1A1 (0.55) | MAPTALDH1A1KDM4EPOLBHTT | |
| SCHEMBL446501 | 0.80 | MAPT (0.64) | MAPTALDH1A1KDM4EGAAPOLB | |
| Hydrochloric Acid SCHEMBL9704969 | 0.79 | MAPT (0.62) | MAPTALDH1A1KDM4EGAAPOLB | |
| Iodide SCHEMBL30309834 | 0.79 | MAPT (0.62) | MAPTALDH1A1KDM4EGAAPOLB | |
| Hydrochloric Acid SCHEMBL27605420 | 0.79 | MAPT (0.62) | MAPTALDH1A1KDM4EGAAPOLB | |
| SCHEMBL13601550 | 0.78 | KDM4E (0.44) | MAPTALDH1A1KDM4E | |
| SCHEMBL12773981 | 0.77 | GNAI3 (0.36) | MAPTALDH1A1KDM4EPOLB | |
| SCHEMBL12881535 | 0.77 | ALDH1A1 (0.34) | MAPTALDH1A1KDM4EPOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7625886-B2 | Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-12-01 | — | — | US | disclosed |
| US-7625886-B2 | Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-12-01 | — | — | US | disclosed |