Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL445196 | 0.87 | ALDH1A1 (0.61) | HSD11B1CYP17A1CYP19A1NAPRTKMT2A | |
| Hydrochloric Acid SCHEMBL28059160 | 0.85 | ALDH1A1 (0.59) | HSD11B1CYP17A1CYP19A1NAPRTKMT2A | |
| SCHEMBL13630753 | 0.81 | CYP1A2 (0.52) | HSD11B1NAPRTTDP1CYP1A2CHRM2 | |
| SCHEMBL8454471 | 0.80 | ALDH1A1 (0.71) | KMT2AALDH1A1LMNATDP1 | |
| SCHEMBL774727 | 0.80 | HSD11B1 (0.44) | HSD11B1CYP17A1CYP19A1NAPRTKMT2A | |
| SCHEMBL29563668 | 0.77 | LMNA (0.51) | HSD11B1CYP17A1CYP19A1NAPRTKMT2A | |
| SCHEMBL493020 | 0.77 | CYP1A2 (0.56) | HSD11B1NAPRTTDP1CYP1A2CHRM2 | |
| SCHEMBL4245622 | 0.76 | KMT2A (0.58) | HSD11B1CYP17A1CYP19A1NAPRTKMT2A | |
| SCHEMBL28711108 | 0.76 | KMT2A (0.58) | CYP17A1CYP19A1NAPRTKMT2AALDH1A1 | |
| SCHEMBL361358 | 0.76 | NAPRT (0.61) | HSD11B1CYP17A1CYP19A1NAPRTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5789595-A | ANTICOAGULANTS | TERUMO KABUSHIKI KAISHA (JP) | 1998-08-04 | — | — | US | disclosed |
| EP-0790247-A1 | TETRAHYDROISOQUINOLINE DERIVATIVE AND MEDICINAL PREPARATION CONTAINING THE SAME | TERUMO KABUSHIKI KAISHA (JP) | 1997-08-20 | — | — | EP | disclosed |