Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 5/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 7/20 | 0.61 |
| ▸ | MEN1 | O00255 | 5/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17066569 | 0.92 | ALDH1A1 (0.72) | GPR55TP53ALDH1A1ALOX12MEN1 | |
| SCHEMBL17066610 | 0.92 | ALDH1A1 (0.68) | GPR55TP53ALDH1A1ALOX12MEN1 | |
| SCHEMBL17066682 | 0.90 | ALDH1A1 (0.62) | GPR55ALDH1A1ALOX12MEN1KMT2A | |
| SCHEMBL17066612 | 0.89 | ALDH1A1 (0.73) | GPR55ALDH1A1ALOX12MEN1KMT2A | |
| SCHEMBL17066643 | 0.89 | TP53 (0.60) | GPR55TP53ALDH1A1ALOX12MEN1 | |
| SCHEMBL16358473 | 0.89 | TP53 (0.62) | GPR55TP53ALDH1A1ALOX12MEN1 | |
| SCHEMBL17066698 | 0.88 | GPR55 (0.72) | GPR55ALDH1A1ALOX12MEN1KMT2A | |
| SCHEMBL17066566 | 0.88 | TP53 (0.59) | GPR55TP53ALDH1A1ALOX12MEN1 | |
| SCHEMBL17066652 | 0.87 | GPR55 (0.69) | GPR55ALDH1A1ALOX12MEN1KMT2A | |
| SCHEMBL17066666 | 0.87 | GPR55 (0.71) | GPR55ALDH1A1ALOX12MEN1KMT2A |
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-9126938-B2 | Phosphatidylcholine transfer protein inhibitors | THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) | 2015-09-08 | — | — | US | disclosed |