Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.44 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31668207 | 0.80 | TTR (0.50) | AKR1C3AKR1C2AKR1C1AKR1C4TTR | |
| SCHEMBL31668196 | 0.79 | TTR (0.51) | TTRALDH1A1LMNAKMT2AHPGD | |
| SCHEMBL31668175 | 0.77 | TTR (0.48) | TTRALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL29067021 | 0.72 | ALDH1A1 (0.75) | ALDH1A1LMNAKMT2AHPGDNPC1 | |
| SCHEMBL28729095 | 0.72 | AKR1C3 (0.73) | AKR1C3AKR1C2AKR1C1AKR1C4ALDH1A1 | |
| SCHEMBL8532176 | 0.70 | ESR1 (0.42) | AKR1C3AKR1C2AKR1C1AKR1C4TTR | |
| SCHEMBL6053862 | 0.70 | CYP3A4 (0.43) | AKR1C3AKR1C2AKR1C1AKR1C4TTR | |
| SCHEMBL28341097 | 0.70 | CYP2D6 (0.46) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL9319407 | 0.69 | AKR1C3 (0.50) | AKR1C3AKR1C2AKR1C1AKR1C4TTR | |
| SCHEMBL1122760 | 0.69 | HCAR2 (0.43) | AKR1C3AKR1C2AKR1C1AKR1C4TTR |
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-5334705-A | Blood substitutes | DUKE UNIVERSITY (US) | 1994-08-02 | — | — | US | disclosed |