Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | AHR | P35869 | 5/20 | 0.43 |
| ▸ | LTA4H | P09960 | 3/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.43 |
| ▸ | F7 | P08709 | 1/20 | 0.43 |
| ▸ | F3 | P13726 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.37 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829814 | 0.76 | TDP1 (0.54) | TDP1GAAALDH1A1MAPTLMNA | |
| SCHEMBL13527924 | 0.75 | TDP1 (0.80) | TDP1GAAALDH1A1MAPTLMNA | |
| SCHEMBL9619818 | 0.74 | TDP1 (0.53) | TDP1GAAALDH1A1MAPTLMNA | |
| SCHEMBL1011575 | 0.72 | KDM4E (0.52) | GAACYP2A6AHRLTA4HNR4A2 | |
| SCHEMBL18000304 | 0.71 | AHR (0.48) | GAACYP2A6AHRLTA4HNR4A2 | |
| SCHEMBL24783239 | 0.71 | CYP2A6 (0.36) | GAACYP2A6AHRLTA4HNR4A2 | |
| SCHEMBL9620111 | 0.71 | TDP1 (0.45) | TDP1GAAALDH1A1MAPTLMNA | |
| SCHEMBL26745466 | 0.71 | DDB1 (0.41) | GAACYP2A6AHRLTA4HNR4A2 | |
| SCHEMBL5580256 | 0.70 | TDP1 (0.56) | TDP1GAAALDH1A1MAPTLMNA | |
| SCHEMBL20656989 | 0.70 | AHR (0.44) | GAACYP2A6AHRLTA4HNR4A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0197294-B1 | BETA-LACTAM ANTIBIOTICS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | BAYER AG (DE) | 1991-04-03 | — | — | EP | disclosed |
| US-4734407-A | ANIMAL GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1988-03-29 | — | — | US | disclosed |
| EP-0197294-A2 | Beta-lactam antibiotics, process for their preparation and their use as medicaments | BAYER AG (DE) | 1986-10-15 | — | — | EP | disclosed |