Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CTSD | P07339 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5184329 | 0.79 | TYMP (0.42) | KMT2AMGLLMEN1 | |
| SCHEMBL17844216 | 0.77 | EPHX1 (0.40) | KDM4EKMT2AMEN1 | |
| SCHEMBL1998329 | 0.73 | ALDH1A1 (0.46) | CYP1A2CYP3A4CYP2C9CYP2C8ADORA2B | |
| SCHEMBL17844195 | 0.72 | ASPH (0.41) | KDM4EALDH1A1KMT2AHPGDMEN1 | |
| SCHEMBL17844110 | 0.71 | MAOA (0.40) | KMT2AMEN1 | |
| SCHEMBL859158 | 0.64 | RAB9A (0.52) | LMNARAB9ASMN1; SMN2KMT2AMGLL | |
| SCHEMBL15212608 | 0.64 | GSK3B (0.59) | CYP1A2CYP3A4CYP2C9CYP2C8ADORA2B | |
| SCHEMBL17844229 | 0.62 | MEN1 (0.48) | KDM4EALDH1A1LMNARAB9ASMN1; SMN2 | |
| SCHEMBL5185885 | 0.62 | LMNA (0.43) | CYP1A2CYP3A4KDM4EALDH1A1LMNA | |
| SCHEMBL5186011 | 0.61 | ALDH1A1 (0.48) | ADORA2BALDH1A1LMNASMN1; SMN2HTT |
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-2016100619-A2 | TREATMENT AND DIAGNOSIS OF CANCER | RGENIX, INC. (US) | 2016-06-23 | — | — | WO | disclosed |