Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6642553 | 0.87 | ALDH1A1 (0.55) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 | |
| SCHEMBL6642558 | 0.87 | ALDH1A1 (0.55) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 | |
| SCHEMBL22708463 | 0.87 | ALDH1A1 (0.57) | HDAC1ALDH1A1ALOX5LMNASETD7 | |
| SCHEMBL2087431 | 0.86 | ALDH1A1 (0.62) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 | |
| SCHEMBL21568019 | 0.85 | ALDH1A1 (0.56) | ALDH1A1ALOX5LMNASETD7POLB | |
| SCHEMBL21552087 | 0.85 | MCHR1 (0.54) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 | |
| Hydrochloric Acid SCHEMBL20547794 | 0.84 | ALDH1A1 (0.60) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 | |
| SCHEMBL30046741 | 0.84 | ALDH1A1 (0.73) | HDAC1ALDH1A1ALOX5LMNASETD7 | |
| SCHEMBL21551943 | 0.83 | ALDH1A1 (0.51) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 | |
| SCHEMBL8150809 | 0.83 | NPC1 (0.63) | HDAC1ALDH1A1ALOX5TMEM97SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019216810-A1 | NEW ANTIFUNGAL COMPOUNDS | URBAN CONSTANTIN (SE) | 2019-11-14 | — | — | WO | claimed |
| WO-2019216810-A1 | NEW ANTIFUNGAL COMPOUNDS | URBAN CONSTANTIN (SE) | 2019-11-14 | — | — | WO | disclosed |
| WO-2019216810-A1 | NEW ANTIFUNGAL COMPOUNDS | URBAN CONSTANTIN (SE) | 2019-11-14 | — | — | WO | disclosed |