Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | CES2 | O00748 | 2/20 | 0.51 |
| ▸ | CES1 | P23141 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.51 |
| ▸ | DAO | P14920 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1937375 | 0.80 | RAB9A (0.58) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL619898 | 0.80 | CES2 (0.64) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL6197413 | 0.79 | RAB9A (0.56) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL29077328 | 0.79 | CES2 (0.61) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL14490190 | 0.79 | CES2 (0.61) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL23793030 | 0.79 | RAB9A (0.56) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL6623068 | 0.77 | RAB9A (0.55) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL2956379 | 0.77 | RAB9A (0.55) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL3839189 | 0.76 | DAO (0.55) | RAB9AALDH1A1NPC1HPGDCES2 | |
| SCHEMBL29018409 | 0.76 | RAB9A (0.58) | RAB9AALDH1A1NPC1HPGDCES2 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |