Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8166609 | 0.72 | NPSR1 (0.37) | NPSR1MDM4TP53ALDH1A1LMNA | |
| SCHEMBL15565552 | 0.67 | KMT2A (0.41) | ALDH1A1LMNAHSD17B10CYP1A2MAPT | |
| SCHEMBL10205212 | 0.64 | LMNA (0.31) | LMNA | |
| SCHEMBL739774 | 0.64 | — | — | |
| SCHEMBL3804852 | 0.63 | KMT2A (0.38) | ALDH1A1LMNAHSD17B10GAACYP1A2 | |
| SCHEMBL10995388 | 0.62 | ADORA1 (0.42) | TP53ALDH1A1LMNAHSD17B10CA1 | |
| SCHEMBL11015282 | 0.62 | KMT2A (0.37) | ALDH1A1GAATSHRKMT2A | |
| SCHEMBL13540000 | 0.62 | HPGD (0.33) | ALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL16316425 | 0.62 | ADORA1 (0.56) | NPSR1MDM4TP53ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL4410483 | 0.62 | — | — |
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-6057445-A | FORMATION OF CARBON NITROGEN BOND, CYCLIZATION AND HALOGENATION | EURO-CELTIQUE S.A. (LU) | 2000-05-02 | — | — | US | disclosed |
| WO-1999031104-A1 | PREPARATION OF 3-SUBSTITUTED ADENINES AND IMIDAZO PYRIDINES | EURO-CELTIQUE, S.A. (LU) | 1999-06-24 | — | — | WO | disclosed |