Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL20495011 | 0.81 | HSD17B10 (0.62) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL38662484 | 0.80 | HSD17B10 (0.67) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL9513404 | 0.78 | TSHR (0.47) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL9675810 | 0.76 | MAPT (0.45) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL3840417 | 0.76 | HSD17B10 (0.71) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL13351516 | 0.75 | IDO1 (0.54) | ALDH1A1KDM4EIDO1 | |
| SCHEMBL8417202 | 0.75 | DDAH1 (0.58) | HSD17B10ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL12940747 | 0.74 | HSD17B10 (0.67) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL30723157 | 0.74 | ALDH1A1 (0.76) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL7357580 | 0.74 | HSD17B10 (0.67) | HSD17B10ALDH1A1KDM4EMAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0433648-A1 | Substituted pyrimidobenzimidazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1991-06-26 | — | — | EP | disclosed |