Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.43 |
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.42 |
| ▸ | RELA | Q04206 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11148314 | 0.98 | MAOB (0.43) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL11484485 | 0.85 | TSHR (0.43) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL10919254 | 0.83 | NPC1 (0.47) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL11160764 | 0.82 | CYP3A4 (0.41) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL11476560 | 0.81 | RAB9A (0.49) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL8575841 | 0.81 | ALDH1A1 (0.44) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL2399420 | 0.80 | NPC1 (0.57) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL10918915 | 0.78 | NPC1 (0.41) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL11147048 | 0.75 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL25062709 | 0.74 | NPC1 (0.45) | NPC1RAB9AKDM4ESMN1; SMN2NFKB1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0023938-B1 | PREPARATION OF PYRROLE-2-ACETATES | McNeilab, Inc. (US) | 1983-07-20 | — | — | EP | claimed |
| EP-0023938-A1 | Preparation of pyrrole-2-acetates | McNeilab, Inc. (US) | 1981-02-18 | — | — | EP | claimed |
| US-4216150-A | Preparation of pyrrole-2-acetates | MCNEIL LAB, INC. (US) | 1980-08-05 | — | — | US | claimed |
| US-4207237-A | Preparation of pyrrole-2-acetates | MCNEILAB, INC. (US) | 1980-06-10 | — | — | US | claimed |
| EP-0023938-B1 | PREPARATION OF PYRROLE-2-ACETATES | McNeilab, Inc. (US) | 1983-07-20 | — | — | EP | disclosed |
| US-4216150-A | Preparation of pyrrole-2-acetates | MCNEIL LAB, INC. (US) | 1980-08-05 | — | — | US | disclosed |
| US-4207237-A | Preparation of pyrrole-2-acetates | MCNEILAB, INC. (US) | 1980-06-10 | — | — | US | disclosed |