Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12842150 | 0.88 | CYP1A2 (0.36) | MAPTALDH1A1KDM4ETSHRSMN1; SMN2 | |
| SCHEMBL13601439 | 0.86 | POLB (0.43) | MAPTALDH1A1KDM4ETSHRPOLB | |
| SCHEMBL12773998 | 0.85 | CYP2C9 (0.37) | MAPTALDH1A1KDM4ETSHRSMN1; SMN2 | |
| SCHEMBL13601395 | 0.83 | TSHR (0.38) | ALDH1A1KDM4ETSHRPOLBSMN1; SMN2 | |
| SCHEMBL12774086 | 0.82 | CYP1A2 (0.37) | MAPTALDH1A1KDM4ETSHRPOLB | |
| SCHEMBL2663390 | 0.80 | MAPT (0.48) | MAPTALDH1A1KDM4ENPSR1POLB | |
| SCHEMBL12774050 | 0.80 | CYP1A2 (0.40) | ALDH1A1TSHRPOLBSMN1; SMN2CYP1A2 | |
| SCHEMBL13601703 | 0.78 | MAPT (0.48) | MAPTALDH1A1KDM4EPOLBGAA | |
| SCHEMBL28404629 | 0.73 | ALDH1A1 (0.60) | MAPTALDH1A1KDM4ETSHRNPSR1 | |
| SCHEMBL824216 | 0.71 | ALDH1A1 (0.39) | MAPTALDH1A1KDM4ETSHRSMN1; 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 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 |