Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 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 | |
|---|---|---|---|---|
| SCHEMBL27051828 | 0.75 | SMN1; SMN2 (0.41) | KMT2ARAB9ACYP2C9ALDH1A1RXRA | |
| SCHEMBL2551684 | 0.71 | MAOB (0.48) | KMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL27051648 | 0.71 | CA12 (0.40) | RAB9AALDH1A1RXRARXRB | |
| SCHEMBL593324 | 0.71 | AKR1C3 (0.59) | AKR1C3KMT2ANR4A2POLBNPC1 | |
| Isophthalic Acid SCHEMBL11234311 | 0.70 | RXRA (0.39) | AKR1C3KMT2ANR4A2POLBNPC1 | |
| SCHEMBL2559861 | 0.70 | MAOB (0.49) | KMT2ANPC1RAB9AALDH1A1 | |
| Isophthalic Acid SCHEMBL28737082 | 0.69 | KMO (0.58) | AKR1C3KMT2APOLBNPC1RAB9A | |
| SCHEMBL12987433 | 0.68 | AKR1C3 (0.56) | AKR1C3KMT2ANR4A2POLBNPC1 | |
| SCHEMBL12327872 | 0.68 | AKR1C3 (0.56) | AKR1C3KMT2ANR4A2POLBNPC1 | |
| SCHEMBL22858454 | 0.68 | ELANE (0.58) | AKR1C3KMT2ANR4A2POLBNPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0579223-B1 | Carboxylic acid derivatives having 5 alpha-reductase inhibitory activity | MITSUBISHI CHEM CORP (JP) | 1996-10-09 | — | — | EP | disclosed |
| US-5385917-A | Treating androgen dependent diseases | MITSUBISHI KASEI CORPORATION (JP) | 1995-01-31 | — | — | US | disclosed |
| EP-0579223-A1 | Carboxylic acid derivatives having 5 alpha-reductase inhibitory activity | Mitsubishi Chemical Corporation (JP) | 1994-01-19 | — | — | EP | disclosed |