Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.66 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 2/20 | 0.46 |
| ▸ | RXRB | P28702 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | DAO | P14920 | 1/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | F10 | P00742 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9513400 | 0.85 | FOLH1 (0.59) | FOLH1KMT2ARXRARXRBRXRG | |
| Bicarbonate SCHEMBL27817695 | 0.85 | DPP4 (0.83) | DPP4FOLH1KMT2ACYP2C19 | |
| SCHEMBL28055856 | 0.84 | DPP4 (0.58) | DPP4FOLH1KMT2AF10CYP2C19 | |
| SCHEMBL2040404 | 0.84 | FOLH1 (0.58) | FOLH1KMT2ARXRARXRBRXRG | |
| SCHEMBL6310180 | 0.82 | FOLH1 (0.56) | FOLH1KMT2ARXRARXRBRXRG | |
| SCHEMBL28697910 | 0.82 | FOLH1 (0.60) | FOLH1KMT2ARXRARXRBRXRG | |
| SCHEMBL18624971 | 0.81 | FOLH1 (0.50) | FOLH1RXRARXRBSRD5A2MAP4K4 | |
| SCHEMBL8368461 | 0.81 | FOLH1 (0.61) | DPP4FOLH1RXRARXRB | |
| SCHEMBL21803820 | 0.81 | TTR (0.51) | DPP4FOLH1KMT2ASRD5A2TSHR | |
| SCHEMBL2981250 | 0.81 | DPP4 (0.91) | DPP4FOLH1KMT2ATP53 |
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-106029057-B | Oral formulations of pyrrolidine derivatives | 奥布赛瓦股份公司 | 2019-09-03 | — | — | CN | disclosed |
| CN-109928905-A | As oxytocins/pitressin V1a receptor antagonist pyrrolidin derivatives | 奥布赛瓦股份公司 | 2019-06-25 | — | — | CN | disclosed |
| CN-109748836-A | As oxytocins/pitressin V1a receptor antagonist pyrrolidin derivatives | 奥布赛瓦股份公司 | 2019-05-14 | — | — | CN | disclosed |
| CN-107674011-A | Pyrrolidin derivatives as oxytocins/pitressin V1a receptor antagonists | 奥布赛瓦股份公司 | 2018-02-09 | — | — | CN | disclosed |
| CN-106795110-A | Crystalline (3Z, 5S) -5- (hydroxymethyl) -1- [ (2 '-methyl-1, 1' -biphenyl-4-yl) carbonyl ] pyrrolidin-3-one O-methyloxime useful in methods of treating disorders associated with OT-R activity | 奥布赛瓦股份公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-106029057-A | Oral formulations of pyrrolidine derivatives | 奥布赛瓦股份公司 | 2016-10-12 | — | — | CN | disclosed |
| CN-105531259-A | Pyrrolidine derivatives as oxytocin/vasopressin V1a receptor antagonists | ObsEva SA | 2016-04-27 | — | — | CN | disclosed |
| CN-101970420-B | Oxadiazole derivatives | MERCK SERONO SA | 2014-09-24 | — | — | CN | disclosed |
| CN-101970420-A | Oxadiazole derivatives | MERCK SERONO SA | 2011-02-09 | — | — | CN | disclosed |
| US-6228985-B1 | COMPOUNDS THAT INHIBIT INTERACTION OF UROKINASE-TYPE PLASMINOGEN ACTIVATOR WITH UROKINASE-TYPE PLASMINOGEN RECEPTOR; ANTITUMOR AGENTS; ANTIMETASTASIS AGENTS; ANTIARTHRITIC AGENTS FOR RHEUMATOID ARTHRITIS | SCHERING CORPORATION | 2001-05-08 | — | — | US | disclosed |