Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.41 |
| ▸ | NCOR1 | O75376 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 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 | |
|---|---|---|---|---|
| SCHEMBL21394713 | 0.89 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2HDAC3NCOR1 | |
| SCHEMBL21395078 | 0.85 | CHEK1 (0.48) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL21394702 | 0.83 | MAOB (0.44) | NPC1RAB9ASMN1; SMN2ALDH1A1PKM | |
| SCHEMBL21395182 | 0.82 | GSK3B (0.44) | NPC1RAB9ASMN1; SMN2ALDH1A1PKM | |
| SCHEMBL21394699 | 0.82 | FFAR2 (0.42) | NPC1RAB9ASMN1; SMN2TDP1BRD4 | |
| SCHEMBL21394653 | 0.81 | RAB9A (0.42) | NPC1RAB9ASMN1; SMN2TDP1BRD4 | |
| SCHEMBL21395072 | 0.81 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2TDP1BRD4 | |
| SCHEMBL29357852 | 0.80 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2HDAC3ALDH1A1 | |
| SCHEMBL21394758 | 0.80 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2HDAC3ALDH1A1 | |
| SCHEMBL29357599 | 0.80 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2TDP1PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020198026-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2020-10-01 | — | — | WO | disclosed |
| WO-2019183587-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2019-09-26 | — | — | WO | disclosed |