Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.44 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6400164 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL562016 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL6405203 | 0.93 | DPP8 (0.47) | ALDH1A1LMNASMN1; SMN2MAPTTDP1 | |
| SCHEMBL6401181 | 0.93 | SMN1; SMN2 (0.50) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL6398767 | 0.90 | TDP1 (0.51) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL23199288 | 0.89 | CYP1A2 (0.50) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL5723978 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL5723982 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL4476414 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A | |
| SCHEMBL28556696 | 0.86 | CYP1A2 (0.52) | ALDH1A1LMNASMN1; SMN2MAPTRAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5071843-A | Thienamycin antibiotics with delayed metabolism | MERCK & CO., INC. (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0161546-B1 | COMBINATION OF 2-SUBSTITUTED CARBAPENEMS WITH DIPEPTIDASE INHIBITORS | MERCK & CO. INC. (US) | 1989-12-13 | — | — | EP | disclosed |
| EP-0161546-A1 | Combination of 2-substituted carbapenems with dipeptidase inhibitors | MERCK & CO. INC. (US) | 1985-11-21 | — | — | EP | disclosed |