Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 8/20 | 0.40 |
| ▸ | KDR | P35968 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11616487 | 0.92 | RAB9A (0.47) | RAB9ASMN1; SMN2NPC1CDK1KDR | |
| SCHEMBL11612196 | 0.91 | RAB9A (0.52) | RAB9ASMN1; SMN2NPC1TP53ALDH1A1 | |
| SCHEMBL11614194 | 0.90 | HSD17B10 (0.54) | RAB9ASMN1; SMN2NPC1TP53ALDH1A1 | |
| SCHEMBL11614645 | 0.90 | HSD17B10 (0.54) | RAB9ASMN1; SMN2NPC1TP53ALDH1A1 | |
| SCHEMBL11613411 | 0.83 | ALDH1A1 (0.40) | RAB9ASMN1; SMN2NPC1TP53CDK1 | |
| SCHEMBL10350458 | 0.83 | RAB9A (0.40) | RAB9ASMN1; SMN2NPC1TP53CDK1 | |
| SCHEMBL11016582 | 0.82 | RAB9A (0.39) | RAB9ASMN1; SMN2NPC1TP53CDK1 | |
| SCHEMBL11614766 | 0.81 | NPC1 (0.52) | RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E | |
| SCHEMBL11610058 | 0.81 | ALDH1A1 (0.46) | RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E | |
| SCHEMBL11613419 | 0.81 | KDM4E (0.43) | RAB9ASMN1; SMN2NPC1TP53ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4066570-A | OPTICAL CELLS, NEMATIC MIXTURES, LIQUID CRYSTALS | HOFFMAN-LA ROCHE INC. (US) | 1978-01-03 | — | — | US | disclosed |
| US-3997536-A | LIQUID CRYSTALS | HOFFMANN-LA ROCHE INC. (US) | 1976-12-14 | — | — | US | disclosed |