Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21395147 | 0.88 | NPC1 (0.39) | CSF1RKDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL29356925 | 0.85 | GCK (0.44) | ABCB1ABCC1KDM4ENPC1RAB9A | |
| SCHEMBL21394784 | 0.85 | GCK (0.44) | ABCB1ABCC1KDM4ENPC1RAB9A | |
| SCHEMBL21394874 | 0.83 | ALDH1A1 (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL29357522 | 0.83 | ALDH1A1 (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL29357109 | 0.83 | TSHR (0.44) | GRM5KDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL21394572 | 0.83 | TSHR (0.44) | GRM5KDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL21395084 | 0.82 | AHR (0.39) | AHRGRM5ABCB1ABCC1CYP3A4 | |
| SCHEMBL22479529 | 0.82 | MET (0.40) | CSF1RNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL21394930 | 0.82 | GRM5 (0.40) | GRM5ABCB1ABCC1KDM4ENPC1 |
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 |