Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10739797 | 0.92 | CYP2D6 (0.47) | KMT2AMEN1CYP2D6TSHRCYP2C19 | |
| SCHEMBL10737356 | 0.89 | MAPT (0.41) | KMT2AMEN1TSHRMAPTRAB9A | |
| SCHEMBL10736825 | 0.87 | MAPT (0.41) | KMT2AMEN1CYP2C19MAPTRAB9A | |
| SCHEMBL10733258 | 0.85 | RAB9A (0.45) | KMT2AMEN1MAPTRAB9APOLB | |
| SCHEMBL10739337 | 0.83 | KDM4E (0.40) | KMT2AMEN1CYP2D6TSHRCYP2C19 | |
| SCHEMBL10737468 | 0.81 | MAPT (0.45) | KMT2ACYP2D6TSHRCYP2C19HIF1A | |
| SCHEMBL10734461 | 0.81 | KDM4E (0.42) | KMT2AMEN1CYP2D6TSHRCYP2C19 | |
| SCHEMBL31495032 | 0.80 | KCNMA1 (0.53) | KMT2AMEN1KCNMA1MAPTRAB9A | |
| SCHEMBL11898964 | 0.79 | KMT2A (0.49) | KMT2AMEN1KCNMA1MAPTRAB9A | |
| SCHEMBL12803808 | 0.78 | SMN1; SMN2 (0.50) | KMT2AMEN1MAPTRAB9AHTT |
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-4686219-A | 11-(Piperazin- or homopiperazin-1-yl)-5H-imidazo-(2,1-C)(1,4)benzodiazepines useful as anti-allergics | BOEHRINGER INGELHEIM KG (DE) | 1987-08-11 | — | — | US | disclosed |