Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.62 |
| ▸ | ALOX12 | P18054 | 8/20 | 0.62 |
| ▸ | MAPT | P10636 | 7/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 5/20 | 0.60 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.59 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL17066515 | 0.93 | ALDH1A1 (0.63) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066571 | 0.92 | ALDH1A1 (0.65) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066690 | 0.91 | ALDH1A1 (0.63) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066659 | 0.90 | ALDH1A1 (0.78) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066675 | 0.90 | GPR55 (0.67) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066622 | 0.89 | ALDH1A1 (0.67) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066509 | 0.89 | ALDH1A1 (0.78) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL17066592 | 0.88 | POLB (0.62) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL13453888 | 0.88 | ALDH1A1 (0.79) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A | |
| SCHEMBL13453922 | 0.87 | ALDH1A1 (0.63) | ALDH1A1ALOX12MAPTSMN1; SMN2KMT2A |
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 |