Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 6/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18586233 | 0.77 | SLC9A1 (0.44) | SLC9A1KMOTDP1GRM2CDK9 | |
| SCHEMBL18616567 | 0.74 | SLC9A1 (0.45) | SLC9A1TDP1GRM2TSHRKMT2A | |
| SCHEMBL18617433 | 0.69 | ALDH1A1 (0.55) | SLC9A1TDP1GRM2TSHRKMT2A | |
| SCHEMBL20658824 | 0.68 | SLC9A1 (0.52) | SLC9A1TDP1GRM2TSHRKMT2A | |
| SCHEMBL20658823 | 0.68 | SLC9A1 (0.52) | SLC9A1TDP1GRM2TSHRKMT2A | |
| SCHEMBL18616566 | 0.68 | SLC9A1 (0.44) | SLC9A1TDP1GRM2TSHRKMT2A | |
| SCHEMBL6299886 | 0.67 | SLC9A1 (0.63) | SLC9A1KMOGRM2CDK9TSHR | |
| SCHEMBL204001 | 0.63 | KMO (0.55) | SLC9A1KMOTDP1GRM2TSHR | |
| SCHEMBL17103035 | 0.63 | SLC9A1 (0.64) | SLC9A1KMOTDP1GRM2PTK2 | |
| SCHEMBL21172013 | 0.63 | MET (0.64) | TDP1GRM2 |
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-2017040449-A1 | TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-03-09 | — | — | WO | disclosed |