Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.47 |
| ▸ | RAB9A | P51151 | 9/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12888666 | 0.80 | NPC1 (0.67) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL11450214 | 0.77 | NPC1 (0.52) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL21854214 | 0.76 | MAPT (0.37) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL6042106 | 0.76 | NPC1 (0.37) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL6042747 | 0.76 | BRD4 (0.39) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL113563 | 0.75 | FGFR1 (0.44) | KMT2AMEN1GAASMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL30322844 | 0.75 | BRD4 (0.36) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL14532534 | 0.75 | POLB (0.58) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL9195583 | 0.72 | NPC1 (0.64) | NPC1RAB9AKMT2AMEN1GAA | |
| SCHEMBL764284 | 0.72 | NPC1 (0.66) | NPC1RAB9AKMT2AMEN1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023139085-A1 | NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2023-07-27 | — | — | WO | disclosed |