Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CD38 | P28907 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12804731 | 0.86 | ALDH1A1 (0.40) | ALDH1A1NQO2SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL18459024 | 0.85 | ALDH1A1 (0.48) | ALDH1A1NQO2SMN1; SMN2NPC1HPGD | |
| SCHEMBL2202059 | 0.80 | ALDH1A1 (0.44) | ALDH1A1NQO2SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL20449762 | 0.79 | NQO2 (0.45) | ALDH1A1NQO2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL30829745 | 0.76 | PARP15 (0.33) | GRM4 | |
| SCHEMBL12566319 | 0.73 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2MEN1KMT2AHPGD | |
| SCHEMBL29937344 | 0.73 | PKLR (0.32) | — | |
| SCHEMBL18416896 | 0.73 | ALDH1A1 (0.41) | ALDH1A1NQO2SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL18459023 | 0.72 | ATP4A (0.35) | ALDH1A1NQO2SMN1; SMN2HPGDTSHR | |
| SCHEMBL30002396 | 0.72 | KIT (0.35) | ALDH1A1SMN1; SMN2RAB9ANPC1MEN1 |
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-2023020534-A1 | COMPOUNDS AND THEIR USES AS MIF INHIBITORS | NANJING IMMUNOPHAGE BIOTECH CO., LTD (CN) | 2023-02-23 | — | — | WO | disclosed |
| WO-2018119387-A1 | SMALL MOLECULE INHIBITORS OF COLONY STIMULATING FACTOR-1 RECEPTOR (CSF-1R) AND USES THEREOF | TESARO, INC. (US) | 2018-06-28 | — | — | WO | disclosed |