Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9346820 | 0.97 | ALDH1A1 (0.54) | ALDH1A1CYP3A4PRSS1S1PR4NPC1 | |
| SCHEMBL11546784 | 0.95 | ALDH1A1 (0.56) | ALDH1A1CYP3A4PRSS1S1PR4NPC1 | |
| SCHEMBL11027291 | 0.89 | ALDH1A1 (0.54) | ALDH1A1CYP3A4PRSS1S1PR4NPC1 | |
| SCHEMBL11545830 | 0.89 | ALDH1A1 (0.56) | ALDH1A1CYP3A4MAPTTSHRMAPK1 | |
| SCHEMBL20030505 | 0.88 | ALDH1A1 (0.49) | ALDH1A1CYP3A4S1PR4NPC1RAB9A | |
| SCHEMBL23110719 | 0.86 | ALDH1A1 (0.53) | ALDH1A1CYP3A4NPC1RAB9ARECQL | |
| SCHEMBL5642200 | 0.82 | ALDH1A1 (0.49) | ALDH1A1CYP3A4MAPTTSHRMAPK1 | |
| SCHEMBL2373598 | 0.80 | ALDH1A1 (0.57) | ALDH1A1CYP3A4NPC1MAPTTSHR | |
| SCHEMBL5732683 | 0.80 | PIN1 (0.49) | ALDH1A1CYP3A4NPC1RAB9AMAPT | |
| SCHEMBL11548711 | 0.79 | TDP1 (0.47) | ALDH1A1CYP3A4PRSS1NPC1RAB9A |
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-4169091-A | Symmetrical and asymmetrical disazo compounds containing a bis-(nitro-aryloxy)alkane middle component | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-09-25 | — | — | US | disclosed |