Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | KMO | O15229 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3516703 | 0.76 | CYP1A2 (0.39) | AHRNPC1RAB9ANOTUMIKBKB | |
| SCHEMBL137915 | 0.71 | AHR (1.00) | AHRCYP1B1NPC1RAB9ANOTUM | |
| SCHEMBL29769221 | 0.71 | AHR (1.00) | AHRCYP1B1NPC1RAB9ANOTUM | |
| SCHEMBL1260864 | 0.68 | RAB9A (0.43) | NPC1RAB9AIKBKBMAPTKDM4E | |
| SCHEMBL9465254 | 0.68 | MKNK1 (0.41) | — | |
| SCHEMBL3757429 | 0.68 | AHR (0.42) | AHRNPC1RAB9AMAPTKDM4E | |
| SCHEMBL2764416 | 0.67 | TDP1 (0.38) | NPC1RAB9ANOTUMKDM4EALDH1A1 | |
| SCHEMBL3590067 | 0.67 | RAB9A (0.38) | NPC1RAB9ANOTUMMAPTKDM4E | |
| SCHEMBL1435657 | 0.67 | AHR (0.46) | AHRCYP1B1NPC1RAB9ANOTUM | |
| SCHEMBL9465643 | 0.67 | CYP2A6 (0.48) | MAPTKDM4EALDH1A1L3MBTL1ALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102596910-B | Androgen receptor modulating compounds | ORION CORP. (FI) | 2015-11-25 | — | — | CN | disclosed |
| CN-105061313-A | Androgen receptor modulating compounds | ORION CORP | 2015-11-18 | — | — | CN | disclosed |