Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 3/20 | 0.46 |
| ▸ | MMP9 | P14780 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL17055002 | 0.81 | MMP2 (0.46) | MMP2MMP9ALDH1A1HPGDKMT2A | |
| SCHEMBL17055001 | 0.81 | MMP2 (0.46) | MMP2MMP9ALDH1A1HPGDKMT2A | |
| SCHEMBL17055196 | 0.81 | MMP2 (0.46) | MMP2MMP9ALDH1A1HPGDKMT2A | |
| SCHEMBL7908682 | 0.77 | MMP2 (0.38) | MMP2MMP9SMN1; SMN2POLBKCNH2 | |
| SCHEMBL17055186 | 0.72 | MMP2 (0.40) | MMP2MMP9ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL7354605 | 0.72 | MMP2 (0.59) | MMP2MMP9SMN1; SMN2MAPTLMNA | |
| SCHEMBL6627039 | 0.70 | MMP2 (0.78) | MMP2MMP9 | |
| SCHEMBL3144811 | 0.69 | ESPL1 (0.43) | ALDH1A1HPGDKMT2AKDM4EMAPT | |
| SCHEMBL14176144 | 0.68 | ATM (0.49) | ALDH1A1KMT2APOLBMAPTLMNA | |
| SCHEMBL10498805 | 0.68 | SIRT6 (0.46) | ALDH1A1HPGDKMT2ASMN1; SMN2POLB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6197975-B1 | 7-AZABICYCLO(2.2.1)HEPTANE-7-CARBONYL-SUBSTITUTED 2-PHENYLINDOLE DERIVATIVES; SEXUAL DISORDERS; ANTICARCINOGENIC AGENTS | MERCK & CO. , INC. | 2001-03-06 | — | — | US | disclosed |
| CN-1209129-A | Antagonists of gonadotropin releasing hormone | MERCK & CO LTD (US) | 1999-02-24 | — | — | CN | disclosed |
| EP-0882040-A4 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | MERCK & CO INC (US) | 1999-02-10 | — | — | EP | disclosed |
| EP-0882040-A1 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | Merck & Co., Inc. (US) | 1998-12-09 | — | — | EP | disclosed |
| WO-1997021707-A1 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | MERCK & CO., INC. (US) | 1997-06-19 | — | — | WO | disclosed |