Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.78 |
| ▸ | CCR1 | P32246 | 1/20 | 0.74 |
| ▸ | FERMT2 | Q96AC1 | 4/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.61 |
| ▸ | BCHE | P06276 | 1/20 | 0.59 |
| ▸ | ACHE | P22303 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL15476608 | 1.00 | CYP1A2 (0.78) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL18290380 | 0.99 | CYP1A2 (0.80) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL22734290 | 0.94 | CYP1A2 (0.74) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL1860945 | 0.92 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL1862287 | 0.92 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL22734279 | 0.89 | FERMT2 (0.67) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL8738060 | 0.88 | CYP1A2 (1.00) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL22735859 | 0.86 | FERMT2 (0.63) | CYP1A2CCR1FERMT2KDM4ELMNA | |
| SCHEMBL15481296 | 0.84 | CCR1 (0.97) | CYP1A2CCR1FERMT2NR4A2MEN1 | |
| SCHEMBL18962393 | 0.84 | CYP1A2 (0.91) | CYP1A2CCR1FERMT2KDM4ELMNA |
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-3848355-A1 | ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY | The Trustees Of The University Of Pennsylvania (US) | 2021-07-14 | — | — | EP | disclosed |