Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.73 |
| ▸ | TP53 | P04637 | 1/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.48 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL19705886 | 1.00 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705885 | 1.00 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL26940074 | 1.00 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705884 | 1.00 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL7928146 | 1.00 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL19705995 | 1.00 | CYP3A4 (0.73) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL14564699 | 0.98 | CYP3A4 (0.68) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL8396968 | 0.93 | — | — | |
| SCHEMBL23591881 | 0.88 | CYP3A4 (0.57) | CYP3A4ALDH1A1TP53SMN1; SMN2LMNA | |
| SCHEMBL1544580 | 0.87 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115089569-A | Use of bipolar trans carotenoids in conjunction with chemotherapy and radiation therapy for the treatment of cancer | 扩散药品有限公司 | 2022-09-23 | — | — | CN | disclosed |
| EP-3519467-B1 | BIS-PHOSPHAGUANIDINE AND POLY-PHOSPHAGUANIDINE LIGANDS WITH GROUP IV METAL CATALYSTS PRODUCED THEREFROM | DOW GLOBAL TECHNOLOGIES LLC (US) | 2021-03-17 | — | — | EP | disclosed |
| US-5864043-A | CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST | KARL THOMAE GMBH (DE) | 1999-01-26 | — | — | US | disclosed |
| US-5541229-A | ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS | DR. KARL THOMAE GMBH (DE) | 1996-07-30 | — | — | US | disclosed |
| US-4125614-A | DIURETIC | HOECHST AKTIENGESELLSCHAFT (DE) | 1978-11-14 | — | — | US | disclosed |
| US-4083979-A | Thiazolidine derivatives and their use as salidiuretics | HOECHST AKTIENGESELLSCHAFT (DT) | 1978-04-11 | — | — | US | disclosed |
| US-4061647-A | DIURETICS | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-12-06 | — | — | US | disclosed |
| US-4061761-A | Thiazolidine derivatives | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-12-06 | — | — | US | disclosed |
| US-4053299-A | NOVEL THIOTRIAZINEDIONES AND THEIR USE AS HERBICIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-10-11 | — | — | US | disclosed |
| US-4049710-A | Novel carbamimidoyl chlorides and their use in the synthesis of herbicidal triazinediones | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-09-20 | — | — | US | disclosed |