Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 1/20 | 0.68 |
| ▸ | HTT | P42858 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | LMNA | P02545 | 3/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | TP53 | P04637 | 2/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.63 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.63 |
| ▸ | SLC40A1 | Q9NP59 | 9/20 | 0.62 |
| ▸ | G6PD | P11413 | 1/20 | 0.62 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.62 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.62 |
| ▸ | METAP2 | P50579 | 1/20 | 0.62 |
| ▸ | METAP1 | P53582 | 1/20 | 0.62 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.62 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.62 |
| ▸ | ATM | Q13315 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL12220831 | 0.84 | MCL1 (0.60) | CLK1HTTSMN1; SMN2LMNATDP1 | |
| SCHEMBL2055416 | 0.83 | CLK1 (0.62) | CLK1HTTSMN1; SMN2LMNATDP1 | |
| SCHEMBL7531380 | 0.80 | HTT (0.52) | CLK1HTTSMN1; SMN2LMNATDP1 | |
| SCHEMBL3269491 | 0.80 | SLC40A1 (0.68) | TDP1SLC40A1G6PDNFKBIAAGTR1 | |
| SCHEMBL2914257 | 0.80 | HTT (0.60) | CLK1HTTSMN1; SMN2LMNATDP1 | |
| SCHEMBL3981512 | 0.79 | METAP2 (0.65) | HTTSMN1; SMN2LMNATDP1SLC40A1 | |
| SCHEMBL11973604 | 0.79 | SLC40A1 (0.67) | HTTSMN1; SMN2TDP1SLC40A1G6PD | |
| SCHEMBL31689606 | 0.78 | CLK1 (0.60) | CLK1HTTSMN1; SMN2LMNATDP1 | |
| SCHEMBL17737443 | 0.78 | RECQL (0.60) | HTTSMN1; SMN2LMNATDP1SLC40A1 | |
| SCHEMBL1428546 | 0.77 | RECQL (1.00) | HTTSMN1; SMN2LMNATDP1SLC40A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016206101-A1 | METALLO-BETA-LACTAMASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-12-29 | — | — | WO | disclosed |
| EP-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| US-6300342-B1 | FOR THERAPY OR INHIBITING THROMBUS FORMATION; FOR THERAPY OF FIBRIN-DEPENDENT INFLAMMATORY CONDITION | BOEHRINGER INGELHEIM PHARM KG (DE) | 2001-10-09 | — | — | US | disclosed |
| EP-0991624-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | Boehringer Ingelheim Pharma KG (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1999000371-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-01-07 | — | — | WO | disclosed |