Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 2/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.44 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.44 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8921828 | 0.88 | ALDH1A1 (0.61) | ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8921130 | 0.86 | MAPT (0.50) | ALDH1A1GSK3BGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8920215 | 0.84 | KDM4E (0.63) | ALDH1A1EGFRMEN1KMT2AKDM4E | |
| SCHEMBL8919874 | 0.82 | GSK3B (0.55) | ALDH1A1GSK3BGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8921390 | 0.80 | KDM4E (0.67) | ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8925163 | 0.79 | ALDH1A1 (0.62) | ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8921245 | 0.78 | GRIN2D (0.49) | ALDH1A1GSK3BGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8920133 | 0.78 | KDM4E (0.51) | ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8921443 | 0.78 | MAPT (0.67) | ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8923489 | 0.77 | KDM4E (0.50) | ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A |
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-5633379-A | N-METHYLASPARTIC ACID ANTAGONIST | CIBA-GEIGY CORPORATION (US) | 1997-05-27 | — | — | US | claimed |
| US-5633379-A | N-METHYLASPARTIC ACID ANTAGONIST | CIBA-GEIGY CORPORATION (US) | 1997-05-27 | — | — | US | disclosed |