Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.38 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.37 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30350 | 0.88 | — | — | |
| SCHEMBL6782595 | 0.88 | TSHR (0.50) | TSHRCYP1A2CYP2D6CYP1B1RAB9A | |
| SCHEMBL6250803 | 0.86 | TSHR (0.48) | TSHRCYP1A2CYP2D6CYP1B1RAB9A | |
| Fluoride SCHEMBL28479463 | 0.86 | — | — | |
| Bromide SCHEMBL3617299 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL6052939 | 0.86 | — | — | |
| Thiophene SCHEMBL15577205 | 0.82 | TSHR (0.47) | TSHRCYP1A2CYP2D6CYP1B1RAB9A | |
| Sulfuric Acid SCHEMBL29716525 | 0.80 | TSHR (0.44) | TSHRCYP1A2CYP2D6CYP1B1RAB9A | |
| Thiophene SCHEMBL11983176 | 0.77 | NAPRT (0.55) | TSHRRAB9ANPC1ATMHSD17B10 | |
| Chloroacetic Acid SCHEMBL10826219 | 0.76 | TSHR (0.53) | TSHRCYP1A2RAB9ANPC1SMN1; SMN2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113527327-A | Thienopyrrole amide derivatives and application thereof in antitumor drugs | 守恒(厦门)医疗科技有限公司 | 2021-10-22 | — | — | CN | claimed |
| CN-113527327-A | Thienopyrrole amide derivatives and application thereof in antitumor drugs | 守恒(厦门)医疗科技有限公司 | 2021-10-22 | — | — | CN | disclosed |
| CN-113527327-A | Thienopyrrole amide derivatives and application thereof in antitumor drugs | 守恒(厦门)医疗科技有限公司 | 2021-10-22 | — | — | CN | disclosed |
| WO-2014041518-A1 | THIENOPYRROLE DERIVATIVES AS ITK INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2014-03-20 | — | — | WO | disclosed |
| WO-2014024119-A1 | HETEROCYCLIC AMIDES AS ITK INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2014-02-13 | — | — | WO | disclosed |
| US-7652046-B2 | Substituted thienopyrrole carboxylic acid amides, pyrrolothiazole carboxylic acid amides, and related analogs as inhibitors of casein kinase I | AVENTIS PHARMACEUTICALS INC. (US) | 2010-01-26 | — | — | US | disclosed |
| US-7393867-B2 | Substituted thienopyrrole carboxylic acid amides, pyrrolothiazole carboxylic acid amides, and related analogs as inhibitors of casein kinase I | AVENTIS PHARMACEUTICALS INC. (US) | 2008-07-01 | — | — | US | disclosed |
| CN-101001861-A | Substituted thienopyrrole carboxylic acid amides, pyrrolothiazole carboxylic acid amides, and related analogs as inhibitors of casein kinase i epsilon | AVENTIS PHARMA INC (US) | 2007-07-18 | — | — | CN | disclosed |