Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15687279 | 0.84 | ACACB (0.51) | TSHRKDM4EALDH1A1ACACBACACA | |
| SCHEMBL1081287 | 0.84 | TSHR (0.49) | TSHRKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL16939384 | 0.84 | TSHR (0.49) | TSHRKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL15683151 | 0.83 | KDM4E (0.44) | TSHRKDM4EALDH1A1CA12CA1 | |
| SCHEMBL28723060 | 0.83 | TSHR (0.47) | TSHRKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL18301340 | 0.83 | KDM4E (0.44) | TSHRKDM4EALDH1A1CA12CA1 | |
| SCHEMBL18188461 | 0.83 | TSHR (0.55) | TSHRKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL760722 | 0.83 | TSHR (0.47) | TSHRALDH1A1MAPTPOLBGAA | |
| SCHEMBL1080968 | 0.83 | TSHR (0.47) | TSHRKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL1144697 | 0.82 | ACACB (0.43) | TSHRKDM4EALDH1A1CA12CA1 |
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-4096333-A | NITROSATION OF A 2-METHYLACETANILIDE | TENNECO CHEMICALS, INC. (US) | 1978-06-20 | — | — | US | disclosed |
| US-3988347-A | NITROSATION OF A 2-METHYL-ACETANILIDE WITH SODIUM NITRITE | TENNECO CHEMICALS, INC. (US) | 1976-10-26 | — | — | US | disclosed |