Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SLC9A1 | P19634 | 8/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19782622 | 0.89 | RAB9A (0.46) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 | |
| SCHEMBL14685487 | 0.78 | RAB9A (0.45) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 | |
| SCHEMBL18899456 | 0.75 | SMN1; SMN2 (0.46) | RAB9ASLC9A1SMN1; SMN2TSHRPOLB | |
| SCHEMBL19829473 | 0.74 | SLC9A1 (0.50) | RAB9ASLC9A1SMN1; SMN2TSHRKCNMA1 | |
| SCHEMBL12204569 | 0.74 | RAB9A (0.56) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 | |
| SCHEMBL19848168 | 0.73 | ALDH1A1 (0.64) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 | |
| SCHEMBL23134778 | 0.72 | SLC9A1 (0.45) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 | |
| SCHEMBL19823277 | 0.72 | RAB9A (0.52) | RAB9ASMN1; SMN2TSHRCYP2C9KCNMA1 | |
| SCHEMBL12204565 | 0.72 | SMN1; SMN2 (0.62) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 | |
| Hydrochloric Acid SCHEMBL27764683 | 0.72 | ALDH1A1 (0.62) | RAB9ASLC9A1SMN1; SMN2TSHRCYP1A2 |
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-2018013774-A1 | BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-01-18 | — | — | WO | disclosed |