Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3073175 | 0.91 | ALDH1A1 (0.39) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| Chrysene SCHEMBL29355502 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| Chrysene SCHEMBL29792076 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| SCHEMBL29451340 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| SCHEMBL25510 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| Chrysene SCHEMBL384031 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| Chrysene SCHEMBL9786466 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| SCHEMBL31177955 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| Chrysene SCHEMBL27115 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 | |
| SCHEMBL29640482 | 0.68 | HPRT1 (1.00) | HPRT1ALDH1A1HSD17B10TDP1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117263999-A | Camptothecin prodrugs and pharmaceutical compositions thereof | 天津和美奥康医药科技有限公司 | 2023-12-22 | — | — | CN | disclosed |
| EP-1261594-A1 | 5,10-DIHYDROACRIDINES AS CALCIUM CHANNEL BLOCKERS | Neuromed Technologies, Inc. (CA) | 2002-12-04 | — | — | EP | disclosed |
| US-6310059-B1 | CONSTRAINED FUSED RING DERIVATIVES OF PIPERIDINE OR PIPERAZINE LINKED TO HYDROPHOBIC SUBSTITUENTS WHICH ENHANCE CALCIUM CHANNEL BLOCKING ACTIVITY; COMBINATORIAL LIBRARIES FOR DRUG SCREENING | NEUROMED TECHNOLOGIES, INC. (CA) | 2001-10-30 | — | — | US | disclosed |
| WO-2001049670-A1 | 5,10-DIHYDROACRIDINES AS CALCIUM CHANNEL BLOCKERS | NEUROMED TECHNOLOGIES, INC. (CA) | 2001-07-12 | — | — | WO | disclosed |