Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 7/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 4/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL21394994 | 0.84 | AHR (0.42) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL21394601 | 0.82 | NPC1 (0.46) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL29356991 | 0.82 | TSHR (0.47) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL29356936 | 0.82 | NPC1 (0.46) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL21394641 | 0.82 | TSHR (0.47) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL21394921 | 0.82 | NPC1 (0.48) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL21394996 | 0.81 | NPC1 (0.40) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL21394711 | 0.80 | NPC1 (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL29358350 | 0.80 | NPC1 (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2PKM | |
| SCHEMBL21394786 | 0.80 | AHR (0.45) | NPC1RAB9AALDH1A1SMN1; SMN2PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019183587-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2019-09-26 | — | — | WO | disclosed |