Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 6/20 | 0.36 |
| ▸ | CNR2 | P34972 | 3/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8875584 | 0.87 | ELANE (0.51) | PARP1CNR1CNR2ELANE | |
| SCHEMBL18967775 | 0.87 | PARP1 (0.39) | PARP1CNR1CNR2ELANEKDM4E | |
| SCHEMBL6946908 | 0.82 | CYP1A2 (0.52) | ELANEKDM4EMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL18967662 | 0.81 | KDM4E (0.34) | KDM4EALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL6946941 | 0.81 | CYP1A2 (0.42) | PARP1CNR1CNR2KDM4ERAB9A | |
| SCHEMBL3622654 | 0.78 | MAPK1 (0.46) | KDM4EALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL1607874 | 0.77 | ELANE (0.54) | ELANEKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL7298497 | 0.75 | MEN1 (0.46) | KDM4EALDH1A1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL18967143 | 0.74 | KMT2A (0.39) | KDM4EALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL12253484 | 0.74 | GLS (0.58) | KDM4EALDH1A1MAPTHPGDRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017098328-A2 | THERAPEUTIC INHIBITORY COMPOUNDS | LIFESCI PHAMACEUTICALS, INC. (BB) | 2017-06-15 | — | — | WO | disclosed |