Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 5/20 | 1.00 |
| ▸ | GAA | P10253 | 4/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 1.00 |
| ▸ | HTT | P42858 | 4/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8041736 | 0.78 | GAA (0.74) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL8057256 | 0.76 | ALDH1A1 (0.61) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL2454536 | 0.74 | ALDH1A1 (0.58) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL29710208 | 0.74 | HTT (1.00) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL8059674 | 0.72 | GAA (0.58) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL13433372 | 0.71 | ALDH1A1 (0.55) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL11405615 | 0.69 | GAA (0.67) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL9970686 | 0.69 | GAA (0.61) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL29368367 | 0.69 | GAA (0.61) | ALDH1A1KMT2AGAAKDM4EHTT | |
| SCHEMBL20117984 | 0.69 | GAA (0.61) | ALDH1A1KMT2AGAAKDM4EHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4016013-A | OR CARBONITRIDESDECOMPOSITION OF TRIAZINE OR PYRIMIDINE COMPOUNDS | CIBA-GEIGY CORPORATION (US) | 1977-04-05 | — | — | US | disclosed |