Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7213726 | 0.95 | HPGD (0.49) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL7219978 | 0.85 | HPGD (0.56) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL3313973 | 0.83 | HPGD (0.51) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL30805704 | 0.82 | HPGD (0.50) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| Hydrochloric Acid SCHEMBL28530423 | 0.81 | HPGD (0.49) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| Hydrochloric Acid SCHEMBL30805705 | 0.81 | HPGD (0.49) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL3791629 | 0.80 | HPGD (0.51) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL4062196 | 0.77 | ALDH1A1 (0.41) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL27933237 | 0.77 | HPGD (0.39) | HPGDALDH1A1L3MBTL1KDM4EGAA | |
| SCHEMBL11370703 | 0.75 | KDM4E (0.56) | HPGDALDH1A1L3MBTL1KDM4EGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4260759-A | CONDENSATION OF NITRILES | SCHERING-CORPORATION (US) | 1981-04-07 | — | — | US | disclosed |
| US-4115395-A | FUNGICIDES, BACTERICIDES | SCHERING CORPORATION (US) | 1978-09-19 | — | — | US | disclosed |
| US-4107166-A | ANTIFUNGAL, ANTIBACTERIAL | SCHERING CORPORATION (US) | 1978-08-15 | — | — | US | disclosed |
| US-4017500-A | FUNGICIDES, BACTERICIDES | SCHERING CORPORATION (US) | 1977-04-12 | — | — | US | disclosed |