Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL27996117 | 0.98 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1HTTKMT2AATM | |
| SCHEMBL28196279 | 0.98 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1HTTKMT2AATM | |
| SCHEMBL154109 | 0.98 | — | — | |
| SCHEMBL1709355 | 0.98 | — | — | |
| SCHEMBL1709350 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL28466963 | 0.95 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1HTTKMT2AATM | |
| Bromide SCHEMBL28466662 | 0.95 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1HTTKMT2AATM | |
| Ammonia Solution, Strong SCHEMBL7851955 | 0.93 | MAPK1 (0.44) | ALDH1A1L3MBTL1HTTKMT2AATM | |
| SCHEMBL28196804 | 0.91 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1HTTKMT2AATM | |
| Cyanide SCHEMBL28091040 | 0.91 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1HTTKMT2AATM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109195965-B | Inhibitors of WDR5 protein-protein binding | 普罗佩纶治疗公司 | 2022-07-26 | — | — | CN | disclosed |
| CN-112672995-A | Novel sulfonamide urea compounds | 英夫拉索姆有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-110769823-A | Methods of using substituted pyrazole and pyrrole compounds and treating hyperproliferative diseases | 班塔姆制药有限责任公司 | 2020-02-07 | — | — | CN | disclosed |