Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NR5A1 | Q13285 | 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 | |
|---|---|---|---|---|
| SCHEMBL8882455 | 0.99 | PTPN1 (0.41) | PTPN1SMPD1LMNAMEN1NR1I2 | |
| SCHEMBL8881872 | 0.95 | SMN1; SMN2 (0.39) | PTPN1SMPD1LMNAMEN1MAPT | |
| SCHEMBL8882459 | 0.91 | IKBKB (0.39) | PTPN1LMNAMEN1MAPTOPRK1 | |
| SCHEMBL8883369 | 0.88 | HPGD (0.37) | LMNAMEN1KMT2ANPC1SMN1; SMN2 | |
| SCHEMBL8882636 | 0.87 | SMN1; SMN2 (0.39) | MEN1KMT2ANPC1SMN1; SMN2TP53 | |
| SCHEMBL8883715 | 0.86 | SMN1; SMN2 (0.37) | LMNAKMT2ANPC1SMN1; SMN2TP53 | |
| SCHEMBL8881773 | 0.83 | HTT (0.40) | HDAC6 | |
| SCHEMBL8882669 | 0.82 | PTPN1 (0.40) | PTPN1SMPD1LMNAMEN1NR1I2 | |
| SCHEMBL8884435 | 0.82 | TDP1 (0.42) | LMNAMAPTNFKB1NFKB2RELA | |
| SCHEMBL8882412 | 0.82 | MEN1 (0.47) | MEN1CYP3A4MAPTKMT2ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5620995-A | Substituted heterocyclic carboxyamides, their preparation and their use as pharmaceuticals | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-04-15 | — | — | US | disclosed |