Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29324351 | 0.85 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| SCHEMBL29324307 | 0.83 | LMNA (0.53) | LMNACAMK2D | |
| SCHEMBL9840700 | 0.81 | ALDH1A1 (0.44) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| SCHEMBL6073363 | 0.79 | CAMK2D (0.51) | CAMK2D | |
| SCHEMBL6073315 | 0.77 | CAMK2D (0.42) | ALDH1A1TDP1CAMK2D | |
| SCHEMBL6073784 | 0.76 | CAMK2D (0.42) | ALDH1A1TDP1CAMK2D | |
| SCHEMBL4176799 | 0.76 | ALDH1A1 (0.43) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| SCHEMBL9320881 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| SCHEMBL5711757 | 0.75 | HSD17B10 (0.42) | ALDH1A1HPGDKDM4EHSD17B10TSHR | |
| SCHEMBL9319953 | 0.75 | SRC (0.35) | ALDH1A1HPGDKDM4EHSD17B10TSHR |
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-5371220-A | Bicyclo-heterocyclic intermediates for cephalosporin compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-12-06 | — | — | US | disclosed |
| US-5232918-A | Bactericides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-08-03 | — | — | US | disclosed |