Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TOP1 | P11387 | 2/20 | 0.41 |
| ▸ | CFD | P00746 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.39 |
| ▸ | GAPDH | P04406 | 1/20 | 0.38 |
| ▸ | JUN | P05412 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL9052230 | 0.86 | TSHR (0.49) | TSHRGAANR3C1TNFSF11JUN | |
| SCHEMBL8741805 | 0.85 | TSHR (0.46) | TSHRALDH1A1ALOX15NR3C1TNFSF11 | |
| SCHEMBL3127157 | 0.84 | ALOX15 (0.59) | ALDH1A1KDM4EGAAALOX15LMNA | |
| SCHEMBL2356556 | 0.83 | ALDH1A1 (0.57) | ALDH1A1ALOX15LMNACYP3A4HIF1A | |
| SCHEMBL3936561 | 0.82 | TSHR (0.55) | TSHRALDH1A1KDM4EGAARAB9A | |
| SCHEMBL18930164 | 0.82 | TSHR (0.55) | TSHRALDH1A1KDM4EGAARAB9A | |
| SCHEMBL178987 | 0.82 | TSHR (0.55) | TSHRALDH1A1KDM4EGAARAB9A | |
| SCHEMBL2308033 | 0.81 | ALOX15 (0.61) | ALDH1A1KDM4EGAAALOX15LMNA | |
| SCHEMBL8231214 | 0.80 | KDM4E (0.56) | TSHRALDH1A1KDM4EGAARAB9A | |
| SCHEMBL7658156 | 0.79 | TSHR (0.51) | TSHRALDH1A1KDM4EGAARAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2961412-A1 | CANCER THERAPY | Triact Therapeutics, Inc. (US) | 2016-01-06 | — | — | EP | disclosed |
| WO-2014134202-A1 | CANCER THERAPY | TRIACT THERAPEUTICS, INC. (US) | 2014-09-04 | — | — | WO | disclosed |
| WO-2010054264-A1 | USE OF CATECHOLIC BUTANE DERIVATIVES IN CANCER THERAPY | TRIACT THERAPEUTICS, INC. (US) | 2010-05-14 | — | — | WO | disclosed |
| EP-0297733-A2 | Pharmaceutical compositions comprising catecholic butanes | BLOCK DRUG COMPANY, INC. (US) | 1989-01-04 | — | — | EP | disclosed |