Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28247996 | 0.82 | CES2 (0.42) | NPC1HPGDRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL28247991 | 0.81 | ALDH1A1 (0.39) | SMN1; SMN2MEN1KMT2A | |
| SCHEMBL28247985 | 0.78 | HTT (0.39) | HTTMIFNPC1HPGDRAB9A | |
| SCHEMBL28865523 | 0.77 | ALDH1A1 (0.44) | NPC1HPGDRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL28248605 | 0.75 | PKM (0.37) | NPC1RAB9ASMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL28248530 | 0.75 | ALOX15 (0.35) | NPC1RAB9ASMN1; SMN2L3MBTL1PKM | |
| SCHEMBL20560218 | 0.71 | HTT (0.46) | HTTNPC1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL31413637 | 0.71 | CA12 (0.46) | HTTNPC1RAB9AMEN1PSMD14 | |
| SCHEMBL28247983 | 0.71 | DGAT1 (0.42) | HTTNPC1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL943477 | 0.71 | APOBEC3G (0.33) | MEN1KMT2A |
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-108698982-A | FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF | 日产化学工业株式会社 | 2018-10-23 | — | — | CN | disclosed |