Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8958678 | 1.00 | AKR1C3 (0.49) | AKR1C3RAB9AMAPTLMNAMEN1 | |
| SCHEMBL9812652 | 0.83 | CA1 (0.48) | RAB9AMAPTLMNAMEN1KMT2A | |
| SCHEMBL8635962 | 0.83 | TDP1 (0.48) | AKR1C3RAB9AMAPTLMNAMEN1 | |
| SCHEMBL8958591 | 0.83 | TDP1 (0.48) | AKR1C3RAB9AMAPTLMNAMEN1 | |
| SCHEMBL1996920 | 0.82 | AKR1C1 (0.53) | AKR1C3LMNAMEN1MAPK1KMT2A | |
| SCHEMBL2407093 | 0.82 | AKR1C1 (0.53) | AKR1C3LMNAMEN1MAPK1KMT2A | |
| SCHEMBL1996915 | 0.82 | AKR1C1 (0.53) | AKR1C3LMNAMEN1MAPK1KMT2A | |
| SCHEMBL8958964 | 0.81 | HTT (0.50) | AKR1C3RAB9AMAPTMEN1MAPK1 | |
| SCHEMBL8958971 | 0.81 | HTT (0.50) | AKR1C3RAB9AMAPTMEN1MAPK1 | |
| SCHEMBL8958972 | 0.81 | AKR1C3 (0.50) | AKR1C3RAB9AMAPTCYP1A2CES2 |
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-5519048-A | 3-(indol-3-yl)-propenoic acid derivatives and pharmaceutical compositions thereof | MERRELL PHARMACEUTICALS INC. (US) | 1996-05-21 | — | — | US | disclosed |