Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.45 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21798465 | 0.90 | HPGD (0.48) | HPGDERCC5FEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL18687120 | 0.81 | TDP1 (0.57) | HPGDALDH1A1SMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL30863826 | 0.79 | TDP1 (0.55) | HPGDALDH1A1SMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL236 | 0.75 | AKR1C3 (0.61) | NPC1RAB9AHPGDKCNK3KCNK9 | |
| SCHEMBL29402362 | 0.75 | AKR1C3 (0.61) | NPC1RAB9AHPGDKCNK3KCNK9 | |
| SCHEMBL9451511 | 0.75 | AKR1C3 (0.61) | NPC1RAB9AHPGDKCNK3KCNK9 | |
| Benzene SCHEMBL27600962 | 0.75 | AKR1C3 (0.61) | NPC1RAB9AHPGDKCNK3KCNK9 | |
| SCHEMBL3627482 | 0.74 | CES2 (0.61) | NPC1RAB9AHPGDKCNK3KCNK9 | |
| Hydrochloric Acid SCHEMBL28594496 | 0.74 | AKR1C3 (0.59) | NPC1RAB9AHPGDKCNK3KCNK9 | |
| Hydrochloric Acid SCHEMBL27617106 | 0.74 | AKR1C3 (0.59) | NPC1RAB9AHPGDKCNK3KCNK9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3622942-A1 | POLYMERIC MATERIALS WITH UNSATURATED TRANSMISSION REAGENTS | Ivoclar Vivadent AG (LI) | 2020-03-18 | — | — | EP | disclosed |