Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | FLT3 | P36888 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.46 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.46 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1659994 | 0.87 | KDM4E (0.52) | NPC1RAB9AMAPTTP53THRB | |
| SCHEMBL31365868 | 0.85 | KDM5B (0.50) | MAPTTP53THRBALDH1A1KDM4E | |
| SCHEMBL28958139 | 0.85 | KDM5B (0.50) | MAPTTP53THRBALDH1A1KDM4E | |
| SCHEMBL8105987 | 0.85 | NPC1 (0.55) | NPC1RAB9AMAPTALDH1A1KDM4E | |
| SCHEMBL1834856 | 0.83 | ADORA3 (0.47) | NPC1MAPTALDH1A1KDM4EHPGD | |
| SCHEMBL8099804 | 0.82 | RAB9A (0.49) | NPC1RAB9AMAPTALDH1A1KDM4E | |
| SCHEMBL8108255 | 0.81 | KDM4E (0.65) | NPC1RAB9AMAPTTP53ALDH1A1 | |
| SCHEMBL20304526 | 0.81 | KDM4E (0.47) | NPC1RAB9AMAPTALDH1A1KDM4E | |
| SCHEMBL7925160 | 0.79 | KDM4E (0.59) | NPC1RAB9AMAPTTP53THRB | |
| SCHEMBL8108170 | 0.77 | PSD (0.48) | NPC1RAB9AMAPTTP53THRB |
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-6071930-A | FOR INHIBITION OF MITOSIS OR TUMOR GROWTH | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2000-06-06 | — | — | US | disclosed |
| US-5994367-A | PREVENT CELL MITOSIS; ANTICARCINOGENIC AGENTS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 1999-11-30 | — | — | US | disclosed |