Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL19350465 | 0.82 | HRH3 (0.47) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL19104416 | 0.82 | PARP1 (0.39) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL12636463 | 0.79 | PARP1 (0.47) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL30209653 | 0.78 | PARP1 (0.40) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL1881628 | 0.77 | PARP1 (0.43) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL28177928 | 0.77 | PARP1 (0.43) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL12886408 | 0.77 | LMNA (0.43) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL1725109 | 0.77 | PARP1 (0.43) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL1130670 | 0.77 | PARP1 (0.43) | PARP1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL14548249 | 0.77 | PARP1 (0.43) | PARP1LMNAGAAKMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109071488-B | Substituted 1,2, 3-triazoles as NR 2B-selective NMDA modulators | 詹森药业有限公司 | 2021-08-13 | — | — | CN | disclosed |
| CN-109071488-A | Substituted 1,2,3- triazole is as NR2B- selective NMDA regulator | 詹森药业有限公司 | 2018-12-21 | — | — | CN | disclosed |