Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28512075 | 1.00 | RAB9A (0.50) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL28513976 | 1.00 | RAB9A (0.50) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL3135552 | 0.84 | RAB9A (0.62) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL17185341 | 0.80 | NPC1 (0.62) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL4770266 | 0.80 | NPC1 (0.67) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL4768172 | 0.79 | NPC1 (0.70) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL2254501 | 0.79 | NPC1 (0.70) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL11920884 | 0.77 | DEGS1 (0.46) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL28503436 | 0.77 | MMP2 (0.42) | RAB9ANPC1SMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL28503437 | 0.77 | MMP2 (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 |
|---|---|---|---|---|---|---|---|
| CN-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |