Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | CTPS1 | P17812 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 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 | |
|---|---|---|---|---|
| SCHEMBL8637449 | 0.80 | ALDH1A1 (0.55) | SMN1; SMN2CYP3A4ALDH1A1TDP1MAPK1 | |
| Dimethylamine SCHEMBL8762028 | 0.78 | CYP3A4 (0.42) | SMN1; SMN2CYP3A4ALDH1A1L3MBTL1TDP1 | |
| SCHEMBL10344444 | 0.78 | CYP3A4 (0.49) | SMN1; SMN2GAACYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL8636087 | 0.76 | MAPT (0.51) | SMN1; SMN2GAAALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL3421894 | 0.76 | ALDH1A1 (0.50) | SMN1; SMN2GAACYP3A4ALDH1A1TDP1 | |
| SCHEMBL8762462 | 0.75 | ALDH1A1 (0.40) | SMN1; SMN2GAACYP3A4ALDH1A1TDP1 | |
| SCHEMBL6570802 | 0.75 | CYP3A4 (0.59) | PARP1SMN1; SMN2GAACYP3A4ALDH1A1 | |
| SCHEMBL8760841 | 0.74 | KMT2A (0.38) | PARP1SMN1; SMN2GAACYP3A4ALDH1A1 | |
| SCHEMBL11762175 | 0.74 | MAPK1 (0.73) | SMN1; SMN2GAACYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL29411996 | 0.74 | MAPT (0.47) | PARP1SMN1; SMN2CYP3A4ALDH1A1HCAR3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5750782-A | ANTICARCINOGENIC AGENTS, ANTIHYPOXIC AGENTS, PRODRUGS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |
| EP-0616609-B1 | NITROANILINE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS | CANCER RES CAMPAIGN TECH (GB) | 1997-06-18 | — | — | EP | disclosed |
| US-5571845-A | Nitroaniline derivatives and their use as anti-tumour agents | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1996-11-05 | — | — | US | disclosed |
| EP-0616609-A1 | NITROANILINE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS. | CANCER RES CAMPAIGN TECH (GB) | 1994-09-28 | — | — | EP | disclosed |
| WO-1993011099-A1 | NITROANILINE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1993-06-10 | — | — | WO | disclosed |