Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3363422 | 0.92 | HRH3 (0.51) | ALDH1A1LMNAAGTR1HRH3MCHR1 | |
| SCHEMBL7974019 | 0.88 | TSHR (0.42) | ALDH1A1LMNAAGTR1TSHRHPGD | |
| SCHEMBL3360999 | 0.83 | ALDH1A1 (0.54) | ALDH1A1LMNAAGTR1HRH3MCHR1 | |
| SCHEMBL2434467 | 0.82 | DRD4 (0.45) | ALDH1A1LMNAAGTR1TSHR | |
| SCHEMBL2434468 | 0.82 | DRD4 (0.45) | ALDH1A1LMNAAGTR1TSHR | |
| SCHEMBL4071714 | 0.80 | OPRK1 (0.53) | HPGDSMN1; SMN2KMT2A | |
| SCHEMBL7980593 | 0.80 | TSHR (0.44) | ALDH1A1LMNAAGTR1HRH3TSHR | |
| SCHEMBL14112346 | 0.77 | MCHR1 (0.48) | ALDH1A1LMNAHRH3MCHR1SMN1; SMN2 | |
| SCHEMBL2433278 | 0.74 | DRD4 (0.46) | ALDH1A1LMNAAGTR1HRH3MCHR1 | |
| SCHEMBL11174620 | 0.72 | PARP1 (0.50) | ALDH1A1LMNAAGTR1CHRM2CHRM4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010011302-A1 | CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | CHDI, INC. (US) | 2010-01-28 | — | — | WO | claimed |
| WO-2010011302-A1 | CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | CHDI, INC. (US) | 2010-01-28 | — | — | WO | disclosed |