Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHB3 | P54753 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 8/20 | 0.41 |
| ▸ | RAB9A | P51151 | 8/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR7 | P34969 | 3/20 | 0.40 |
| ▸ | HTR6 | P50406 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9525882 | 0.77 | TGFBR1 (0.46) | EPHB3NPC1RAB9ADRD2HTR2A | |
| SCHEMBL3155189 | 0.77 | ADORA3 (0.44) | EPHB3NPC1RAB9ADRD2HTR2A | |
| SCHEMBL21808337 | 0.74 | HTR2A (0.42) | EPHB3NPC1RAB9ADRD2HTR2A | |
| SCHEMBL8827534 | 0.74 | GAA (0.54) | NPC1RAB9ASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL792707 | 0.73 | ADORA3 (0.44) | EPHB3NPC1RAB9ADRD2HTR2A | |
| SCHEMBL25703657 | 0.73 | FLT3 (0.46) | EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL24803763 | 0.71 | ADORA3 (0.42) | NPC1RAB9ADRD2HTR2AHTR7 | |
| SCHEMBL2017759 | 0.70 | NPC1 (0.59) | EPHB3NPC1RAB9AADORA3NPSR1 | |
| Hydrochloric Acid SCHEMBL29440777 | 0.69 | NPC1 (0.57) | EPHB3NPC1RAB9ANPSR1 | |
| SCHEMBL6347546 | 0.67 | ALDH1A1 (0.58) | NPC1RAB9ASMN1; SMN2ALDH1A1HPGD |
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-5534482-A | CONTROLLING BLACK GRASS AND DOWNY BROME; WHEAT, BARLEY, OATS, AND RYE | TAKEDA CHEMICAL INDUSTRIES, LTD. | 1996-07-09 | — | — | US | disclosed |