Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL4427422 | 0.90 | ALDH1A1 (0.46) | ALDH1A1ADRA2AADRA2BADRA2CNOTUM | |
| SCHEMBL27689229 | 0.80 | HTR1D (0.44) | ALDH1A1ADRA2AGPR35MAPTLMNA | |
| SCHEMBL22421151 | 0.75 | ALDH1A1 (0.47) | ALDH1A1NOTUMMAPTLMNAHTT | |
| SCHEMBL29599871 | 0.74 | NOTUM (0.55) | ALDH1A1ADRA2ANOTUMHSD17B10MAPT | |
| SCHEMBL1877071 | 0.74 | NOTUM (0.55) | ALDH1A1ADRA2ANOTUMHSD17B10MAPT | |
| SCHEMBL3506059 | 0.73 | ALDH1A1 (0.48) | ALDH1A1ADRA2AADRA2BADRA2CHSD17B10 | |
| SCHEMBL28330461 | 0.72 | ALDH1A1 (0.42) | ALDH1A1HSD17B10GPR35MAPTTDP1 | |
| SCHEMBL6626721 | 0.72 | ALDH1A1 (0.34) | ALDH1A1ADRA2AADRA2BADRA2CHSD17B10 | |
| SCHEMBL28548105 | 0.71 | MAPT (0.44) | ALDH1A1ADRA2AMAPTLMNAHTT | |
| SCHEMBL29581205 | 0.71 | MAPT (0.44) | ALDH1A1ADRA2AMAPTLMNAHTT |
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-1956954-B | Novel androgens | ORGANON NV | 2011-05-04 | — | — | CN | disclosed |
| CN-1956954-A | Novel androgens | ORGANON NV (NL) | 2007-05-02 | — | — | CN | disclosed |