Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GALR3 | O60755 | 1/20 | 0.44 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TYMS | P04818 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2361081 | 0.88 | CYP3A4 (0.46) | ALDH1A1GAAMEN1KMT2ANPSR1 | |
| SCHEMBL6104023 | 0.84 | ALDH1A1 (0.54) | ALDH1A1GAAPOLBMEN1KMT2A | |
| SCHEMBL7464878 | 0.81 | CYP11B1 (0.56) | ALDH1A1GAACYP19A1CYP11B1CYP11B2 | |
| SCHEMBL8260760 | 0.78 | AGTR1 (0.48) | — | |
| Hydrochloric Acid SCHEMBL7642988 | 0.76 | GALR3 (0.48) | GALR3NR2F2ALDH1A1GAAHPGD | |
| SCHEMBL31591021 | 0.76 | ALDH1A1 (0.44) | GALR3NR2F2ALDH1A1GAAHPGD | |
| SCHEMBL13467083 | 0.73 | PTGER4 (0.36) | ALDH1A1GAALMNACYP2C19CYP3A4 | |
| SCHEMBL6410513 | 0.72 | CACNA1H (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL29956774 | 0.72 | ALDH1A1 (0.46) | ALDH1A1HPGDPOLBMEN1KMT2A | |
| SCHEMBL17735990 | 0.72 | MAPT (0.42) | ALDH1A1MEN1KMT2ANPSR1LMNA |
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-6358956-B1 | IMIDAZOLYLALKYL-1-PIPERAZINE DERIVATIVES; FARNESYL-PROTEIN AND GERANYLGERANYL TRANSFERASE INHIBITORS; ANTICARCINOGENIC AGENTS | MERCK & CO., INC. | 2002-03-19 | — | — | US | disclosed |