Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19306551 | 0.81 | SYK (0.38) | NPC1RAB9ASMN1; SMN2ALDH1A1PARP10 | |
| SCHEMBL8864857 | 0.77 | CYP1A2 (0.41) | SMN1; SMN2LMNAHDAC6HDAC1ALDH1A1 | |
| SCHEMBL10361551 | 0.76 | SYK (0.43) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL27314447 | 0.75 | DUT (0.34) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL29971961 | 0.75 | ALDH1A1 (0.47) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL8865661 | 0.74 | PTPRA (0.37) | CA12CA1CA2CA9HDAC6 | |
| SCHEMBL8865657 | 0.74 | CYP1A2 (0.41) | SMN1; SMN2HDAC6HDAC1ALDH1A1HPGD | |
| SCHEMBL9852114 | 0.73 | CYP1A2 (0.42) | SMN1; SMN2LMNAHDAC6HDAC1ALDH1A1 | |
| SCHEMBL21638042 | 0.72 | CHRM2 (0.60) | LMNAALDH1A1HPGDTSHRCYP1A2 | |
| SCHEMBL4052172 | 0.71 | NPC1 (0.45) | NPC1RAB9ASMN1; SMN2LMNAHDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5672701-A | 4-substituted alkyl carbapenem antibiotics | BRISTOL-MYERS SQUIBB COMPANY (US) | 1997-09-30 | — | — | US | disclosed |
| EP-0433759-A1 | 4-Substituted alkyl carbapenem antibiotics | Bristol-Myers Squibb Company (US) | 1991-06-26 | — | — | EP | disclosed |