Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TYMS | P04818 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12892268 | 0.86 | ALDH1A1 (0.40) | ALDH1A1HPGDSMN1; SMN2HSD17B10TYMS | |
| SCHEMBL16809191 | 0.80 | ALDH1A1 (0.58) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL11546307 | 0.79 | TYMS (0.60) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL8502461 | 0.79 | HPGD (0.51) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL18932089 | 0.76 | ALDH1A1 (0.55) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL229608 | 0.76 | KMT2A (0.58) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL29822916 | 0.75 | ALDH1A1 (0.37) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL28822617 | 0.75 | ALDH1A1 (0.37) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL23717308 | 0.75 | ALDH1A1 (0.77) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| Fluoride SCHEMBL31379728 | 0.74 | KMT2A (0.56) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6043242-A | TREATING A MAMMAL AFFLICTED WITH A DISEASE BASED ON HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 2000-03-28 | — | — | US | disclosed |
| EP-0946559-A2 | IMIDAZOPYRIDAZINES | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998028299-A2 | IMIDAZOPYRIDAZINES | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1998-07-02 | — | — | WO | disclosed |