Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2017274 | 0.88 | MEN1 (0.51) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2021907 | 0.82 | NPC1 (0.51) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2016768 | 0.80 | SRD5A2 (0.50) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL16918467 | 0.80 | SRD5A2 (0.50) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2016771 | 0.80 | SRD5A2 (0.50) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL14327913 | 0.79 | NPC1 (0.51) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL12320537 | 0.79 | MEN1 (0.50) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL14327918 | 0.77 | MEN1 (0.55) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2019621 | 0.77 | MAOB (0.51) | SRD5A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2021475 | 0.77 | SRD5A2 (0.49) | SRD5A2MEN1KMT2ANPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105816453-B | Substituted tricyclic acid derivatives as S1P1 receptor agonists for the treatment of autoimmune and inflammatory disorders | 艾尼纳制药公司 | 2021-03-05 | — | — | CN | disclosed |