Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14282584 | 0.92 | AKR1C3 (0.44) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL8986306 | 0.87 | AKR1C3 (0.40) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL13328292 | 0.85 | ALDH1A1 (0.47) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL11922326 | 0.85 | AKR1C3 (0.38) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL8986301 | 0.85 | AKR1C3 (0.38) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL11921695 | 0.84 | MAPT (0.34) | LMNAALDH1A1SRD5A2MEN1KMT2A | |
| SCHEMBL8986300 | 0.84 | AKR1C3 (0.38) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL8986302 | 0.80 | MEN1 (0.36) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL8986303 | 0.79 | LMNA (0.37) | AKR1C3LMNAALDH1A1SRD5A2CES2 | |
| SCHEMBL11920184 | 0.79 | AKR1C3 (0.36) | AKR1C3LMNAALDH1A1SRD5A2CES2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8304561-B2 | Synthetic route to ABCD-porphyrins | NORTH CAROLINA STATE UNIVERSITY (US) | 2012-11-06 | — | — | US | disclosed |