Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 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 | |
|---|---|---|---|---|
| 1-Allyloxy-4-Ethoxybenzene SCHEMBL2846327 | 0.74 | NQO1 (0.64) | NQO1TSHRTDP1PARP10RELA | |
| SCHEMBL4183027 | 0.73 | NQO1 (0.70) | NQO1TSHRTDP1PARP10RELA | |
| 1,4-Diethoxybenzene SCHEMBL27616183 | 0.72 | NQO1 (0.88) | NQO1TSHRTDP1PARP10RELA | |
| 1,4-Diethoxybenzene SCHEMBL28186701 | 0.72 | NQO1 (1.00) | NQO1TSHRTDP1PARP10RELA | |
| 1,4-Diethoxybenzene SCHEMBL124015 | 0.72 | NQO1 (1.00) | NQO1TSHRTDP1PARP10RELA | |
| SCHEMBL6652455 | 0.71 | NQO1 (0.67) | NQO1TSHRTDP1PARP10RELA | |
| SCHEMBL627031 | 0.71 | SMN1; SMN2 (0.64) | NQO1TSHRTDP1RELALTA4H | |
| SCHEMBL2786031 | 0.70 | NQO1 (0.64) | NQO1TSHRTDP1PARP10RELA | |
| SCHEMBL11518638 | 0.70 | NQO1 (0.64) | NQO1TSHRTDP1PARP10RELA | |
| SCHEMBL9003450 | 0.70 | LMNA (0.36) | RELAMAPTSMN1; SMN2NPC1RAB9A |
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-3966720-A | Process for producing desacetoxy cephalosporanic acid compound | NIKKEN CHEMICALS CO., LTD. (JA) | 1976-06-29 | — | — | US | claimed |