Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | METAP2 | P50579 | 1/20 | 0.44 |
| ▸ | METAP1 | P53582 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29186335 | 0.74 | NPC1 (0.42) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| SCHEMBL1535707 | 0.64 | NPC1 (0.69) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| SCHEMBL30659969 | 0.64 | NPC1 (0.69) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| SCHEMBL30659968 | 0.64 | NPC1 (0.69) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| Hydrochloric Acid SCHEMBL2147494 | 0.64 | METAP2 (0.96) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| Hydrochloric Acid SCHEMBL2146963 | 0.63 | RAB9A (0.62) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| Hydrochloric Acid SCHEMBL2491054 | 0.62 | KDM4E (0.67) | NPC1RAB9ALMNASMN1; SMN2HPGD | |
| SCHEMBL111276 | 0.62 | RAB9A (0.66) | NPC1RAB9ASMN1; SMN2HPGDPKM | |
| SCHEMBL29391888 | 0.62 | RAB9A (0.66) | NPC1RAB9ASMN1; SMN2HPGDPKM | |
| SCHEMBL75449 | 0.62 | ALDH1A1 (0.60) | NPC1RAB9ASMN1; SMN2PKMKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-87100363-A | 2-benzimidazolyl-alkylthio (or sulfinyl or sulphonyl agent) derivative, its preparation method and medicinal application | — | 1987-09-02 | — | — | CN | claimed |