Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.54 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3485765 | 1.00 | AKR1C3 (0.55) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| SCHEMBL83065 | 1.00 | AKR1C3 (0.55) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| SCHEMBL8351839 | 0.98 | AKR1C3 (0.53) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| Hydrochloric Acid SCHEMBL10437231 | 0.98 | AKR1C3 (0.53) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| Ammonia Solution, Strong SCHEMBL4743624 | 0.98 | ABCG2 (0.56) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| Acrylic Acid SCHEMBL2468603 | 0.91 | ABCG2 (0.48) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| Cyanamide SCHEMBL5277769 | 0.89 | MCL1 (0.47) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| Tert-Butylbenzene SCHEMBL31552779 | 0.88 | ABCG2 (0.46) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| Monoethanolamine SCHEMBL30202395 | 0.88 | ABCG2 (0.46) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL | |
| SCHEMBL9103420 | 0.88 | ABCG2 (0.54) | AKR1C3ABCG2AKR1C1ALDH1A1RECQL |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110160390-B | Non-contact efficient enhanced heat transfer system and method for pipeline resistance reduction flow | 中国石油大学(北京) | 2020-05-01 | — | — | CN | claimed |
| CN-110160390-B | Non-contact efficient enhanced heat transfer system and method for pipeline resistance reduction flow | 中国石油大学(北京) | 2020-05-01 | — | — | CN | disclosed |
| CN-110160390-B | Non-contact efficient enhanced heat transfer system and method for pipeline resistance reduction flow | 中国石油大学(北京) | 2020-05-01 | — | — | CN | disclosed |
| EP-2086963-A2 | HEPATITIS C VIRUS INHIBITORS | Brystol-Myers Squibb Company (US) | 2009-08-12 | — | — | EP | disclosed |
| WO-2008060927-A2 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-22 | — | — | WO | disclosed |
| EP-0992485-B1 | Chiral compounds | MERCK PATENT GMBH (DE) | 2003-07-30 | — | — | EP | disclosed |
| US-6495217-B2 | LIQUID CRYSTALS | MERCK PATENT GMBH (DE) | 2002-12-17 | — | — | US | disclosed |
| US-20020005505-A1 | CHIRAL COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2002-01-17 | — | — | US | disclosed |
| EP-0992485-A1 | Chiral compounds | MERCK PATENT GmbH (DE) | 2000-04-12 | — | — | EP | disclosed |
| US-4535130-A | SUNSCREEN AGENTS, SKIN CREAMS | SOCIETE NATIONALE ELF AQUITAINE (PRODUCTION) (FR) | 1985-08-13 | — | — | US | disclosed |
| US-4435545-A | AN EPOXY-CONTAINING POLYOLEFIN OR ACRYLATE IS REACTED WITH SALICYLIC ACID, CINNAMIC ACID OR METHOXYCINNAMIC ACID | SOCIETE NATIONALE ELF AQUITAINE (PRODUCTION) (FR) | 1984-03-06 | — | — | US | disclosed |