Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | TOP2A | P11388 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774867 | 0.91 | CTRC (0.39) | RAB9ANPC1ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL8775021 | 0.91 | TAAR1 (0.39) | RAB9ANPC1ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL8774859 | 0.90 | HTR2A (0.42) | ALDH1A1TP53HSD17B10KDM4ELPL | |
| SCHEMBL8774829 | 0.85 | RAB9A (0.36) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL8774334 | 0.81 | NPC1 (0.40) | RAB9ANPC1TP53PKMSMN1; SMN2 | |
| SCHEMBL8774007 | 0.80 | RAB9A (0.42) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL8774498 | 0.76 | HTR2A (0.40) | RAB9ANPC1ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL8774969 | 0.76 | FFAR1 (0.42) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL8775165 | 0.76 | TAAR1 (0.42) | RAB9ANPC1TP53GPR84 | |
| SCHEMBL8774823 | 0.75 | HTR2A (0.46) | ALDH1A1TP53HSD17B10KDM4ELPL |
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 |
|---|---|---|---|---|---|---|---|
| EP-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |