Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | MMP16 | P51512 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28021034 | 0.85 | AKR1B1 (0.55) | AKR1B1MAPTTDP1L3MBTL1ATM | |
| SCHEMBL29044269 | 0.79 | ELANE (0.38) | ALOX15HPGDHSD17B10RAB9AMAPT | |
| SCHEMBL6262232 | 0.79 | ELANE (0.38) | ALOX15HPGDHSD17B10RAB9AMAPT | |
| SCHEMBL8646599 | 0.76 | ALOX15 (0.50) | ALOX15HPGDHSD17B10NPC1RAB9A | |
| SCHEMBL9028297 | 0.75 | ELANE (0.36) | ALOX15HPGDHSD17B10MAPTTDP1 | |
| SCHEMBL27848448 | 0.72 | ELANE (0.44) | ALOX15HPGDHSD17B10MAPTTDP1 | |
| SCHEMBL28935655 | 0.70 | ALDH1A1 (0.40) | ALOX15HPGDHSD17B10MAPTTDP1 | |
| SCHEMBL4347894 | 0.70 | HPGD (0.41) | ALOX15HPGDHSD17B10NPC1RAB9A | |
| SCHEMBL4405818 | 0.69 | ELANE (0.45) | HPGDNPC1PKMRAB9AMAPT | |
| SCHEMBL7741682 | 0.69 | CYP3A4 (0.46) | AKR1B1NPC1RAB9AMAPTL3MBTL1 |
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-5744635-A | REACTING THE CORRESPONDING HALOGEN SUBSTITUTED COMPOUND WITH AN ORGANOMETALLIC COMPOUND | Uclaf, Roussel (FR) | 1998-04-28 | — | — | US | disclosed |