Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LSS | P48449 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| (Chloromethyl)Benzene SCHEMBL2179529 | 0.84 | TDP1 (0.45) | CYP19A1CYP11B1CYP11B2TSHRNAPRT | |
| (Chloromethyl)Benzene SCHEMBL27526930 | 0.82 | TDP1 (0.43) | CYP19A1CYP11B1CYP11B2TSHRNAPRT | |
| Pyridine SCHEMBL10890647 | 0.82 | TSHR (0.43) | CYP19A1CYP11B1TSHRNAPRTTDP1 | |
| SCHEMBL120896 | 0.81 | — | — | |
| Methane SCHEMBL28356057 | 0.78 | IDO1 (0.52) | KDM4ECYP2A6IDO1 | |
| SCHEMBL4989141 | 0.78 | IDO1 (0.52) | KDM4ECYP2A6IDO1 | |
| Phosphine SCHEMBL4870393 | 0.78 | IDO1 (0.52) | KDM4ECYP2A6IDO1 | |
| SCHEMBL3986244 | 0.78 | IDO1 (0.52) | KDM4ECYP2A6IDO1 | |
| Hydrochloric Acid SCHEMBL11121998 | 0.78 | IDO1 (0.52) | KDM4ECYP2A6NPC1RAB9AIDO1 | |
| Pyridine SCHEMBL15644026 | 0.76 | GAA (0.46) | KDM4ECYP2A6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080201095-A1 | Method for Calibrating an Analytical Instrument | VERMILLION, INC. | 2008-08-21 | — | — | US | disclosed |
| WO-2008100941-A2 | A METHOD FOR CALIBRATING AN ANALYTICAL INSTRUMENT | CORRELOGIC SYSTEMS INC. (US) | 2008-08-21 | — | — | WO | disclosed |