Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24263084 | 0.89 | KMT2A (0.42) | RAB9ANPC1SMN1; SMN2HPGDLMNA | |
| SCHEMBL24263131 | 0.89 | HDAC8 (0.45) | LMNAPAK1SMYD3GAANAMPT | |
| SCHEMBL24263090 | 0.89 | NPC1 (0.47) | RAB9ANPC1PAK1SMYD3GAA | |
| SCHEMBL24263129 | 0.89 | HDAC8 (0.48) | RAB9ANPC1SMYD3 | |
| SCHEMBL24263134 | 0.89 | SMYD3 (0.39) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL24263127 | 0.88 | MTNR1A (0.46) | RAB9ANPC1SMN1; SMN2CRBNGAA | |
| SCHEMBL24263197 | 0.88 | TAOK1 (0.48) | LMNASMYD3CRBNGAAALDH1A1 | |
| SCHEMBL24263089 | 0.88 | KDM5A (0.40) | RAB9ANPC1SMN1; SMN2LMNASMYD3 | |
| SCHEMBL24263079 | 0.86 | TAOK1 (0.40) | SMYD3CRBNGAAALDH1A1MTNR1A | |
| SCHEMBL24263227 | 0.85 | HDAC8 (0.42) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 |
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-2022040508-A1 | COMPOUNDS AND METHODS FOR TREATING AUTOIMMUNE DISORDERS BY TARGETING HLA-DQ2 | IMMUNOMOLECULAR THERAPEUTICS, INC. (US) | 2022-02-24 | — | — | WO | disclosed |