Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | CTSC | P53634 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CCR3 | P51677 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24263083 | 0.90 | NPC1 (0.46) | NPC1RAB9AUSP2TSHRKMT2A | |
| SCHEMBL24263202 | 0.89 | CHRNB2 (0.47) | KMT2AHDAC6MEN1 | |
| SCHEMBL24263096 | 0.89 | ALDH1A1 (0.40) | NPC1RAB9ATSHRKMT2AHPGD | |
| SCHEMBL24263130 | 0.89 | MEN1 (0.48) | NPC1RAB9AKMT2AHPGDHDAC8 | |
| SCHEMBL24263099 | 0.89 | HDAC8 (0.41) | NPC1RAB9AKMT2AHPGDHDAC8 | |
| SCHEMBL24263210 | 0.89 | MTNR1A (0.47) | NPC1RAB9ACTSBCTSSCTSK | |
| SCHEMBL24263225 | 0.85 | SMN1; SMN2 (0.52) | NPC1RAB9AKMT2AHPGDALDH1A1 | |
| SCHEMBL24263219 | 0.84 | DRD4 (0.46) | SLC6A12 | |
| SCHEMBL24263229 | 0.82 | MEN1 (0.55) | TSHRKMT2AHDAC8MEN1ALDH1A1 | |
| SCHEMBL24263232 | 0.81 | MTNR1A (0.49) | HPGDALDH1A1HTR2CMTNR1AMTNR1B |
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 |